data_1suy_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 1suy _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 full ' A' A ' 1' ' ' ALA . . . . . 0.48 ' O ' ' C ' ' A' ' 2' ' ' MET . . . . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 109.022 -0.733 . . . . 8.02 109.022 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 1.143 ' HE3' ' O ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -37.37 148.38 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.74 -0.837 . . . . 5.46 108.74 178.906 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.844 ' O ' ' HG2' ' A' ' 4' ' ' ARG . . . -42.54 86.37 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 118.345 -1.342 . . . . 4.73 108.284 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 1.039 HH11 ' HG3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER 54.07 20.58 2.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.677 -0.692 . . . . 8.73 111.382 -179.099 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . 1.01 ' O ' ' SD ' ' A' ' 2' ' ' MET . 19.1 mtt -81.8 89.0 6.28 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.602 -0.439 . . . . 5.51 110.164 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.73 168.33 20.27 Favored Pre-proline 0 C--N 1.331 -0.198 0 C-N-CA 120.371 -0.532 . . . . 2.37 109.575 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -67.87 -13.07 37.41 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.147 1.898 . . . . 1.72 111.749 -179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.58 -55.59 6.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.996 -0.547 . . . . 1.45 110.121 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.409 ' O ' ' HB3' ' A' ' 12' ' ' LYS . 88.1 m-20 -46.09 -45.84 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.815 -0.439 . . . . 1.41 109.815 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.954 ' HE3' ' OE1' ' C' ' 432' ' ' GLU . 0.1 OUTLIER -59.35 -46.17 89.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.43 -0.581 . . . . 2.42 109.43 179.155 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.634 ' O ' ' HD2' ' A' ' 11' ' ' ARG . 5.0 tpt180 -62.09 -38.51 89.12 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.033 -0.729 . . . . 2.63 109.033 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.409 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.3 OUTLIER -58.61 -44.64 89.97 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.096 -1.076 . . . . 2.49 108.096 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.863 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -58.13 -49.23 77.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.456 -0.942 . . . . 1.17 108.456 177.826 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 1.021 HD22 ' OE1' ' A' ' 55' ' ' GLN . 47.4 mt -56.64 -44.57 81.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.265 -0.879 . . . . 1.17 109.239 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -58.55 -39.05 79.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.264 -0.88 . . . . 1.16 109.942 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.66 ' O ' HG13 ' A' ' 20' ' ' ILE . 56.4 mt-10 -79.08 -43.94 23.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 1.79 110.144 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.863 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 48.6 mt -59.39 -35.84 74.7 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.97 -0.752 . . . . 1.23 108.97 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 14' ' ' LEU . 18.0 ttt180 -61.67 -53.81 51.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.086 -0.961 . . . . 3.77 109.7 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.26 79.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.84 -0.618 . . . . 1.76 110.056 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.66 HG13 ' O ' ' A' ' 16' ' ' GLU . 93.2 mt -57.83 -51.4 70.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 109.608 -0.515 . . . . 1.09 109.608 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.416 ' O ' ' HB ' ' A' ' 24' ' ' ILE . 67.8 t80 -53.34 -51.32 62.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.404 -0.962 . . . . 0.85 108.404 178.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HD2' HG12 ' D' ' 506' ' ' ILE . 22.4 ttp180 -52.77 -50.32 63.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.5 -1.227 . . . . 2.76 110.309 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . 0.458 ' CG2' ' HD2' ' A' ' 38' ' ' ARG . 81.2 m -55.85 -41.46 74.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.018 -0.537 . . . . 1.08 110.381 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.59 HG12 ' CB ' ' A' ' 38' ' ' ARG . 84.0 mt -55.44 -40.13 56.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 1.09 110.195 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.661 HG12 ' CD1' ' A' ' 84' ' ' TYR . 78.2 t -66.64 -49.91 70.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 1.09 111.134 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CD2' ' HA2' ' D' ' 508' ' ' GLY . 51.2 mt -58.45 -38.65 77.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 1.22 111.272 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.628 ' CD ' ' HE ' ' A' ' 38' ' ' ARG . 93.8 mt-10 -88.12 -6.94 57.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.452 -0.34 . . . . 1.04 111.574 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -51.3 -32.47 25.16 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.464 -0.495 . . . . 1.09 110.219 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 1.093 ' HB3' ' NH1' ' D' ' 512' ' ' ARG . 39.5 m-85 -107.43 17.3 22.94 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.981 -0.554 . . . . 0.71 110.638 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.937 HD21 ' N ' ' A' ' 33' ' ' ALA . 2.3 p-10 -59.73 149.92 29.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 1.09 110.675 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.9 p -91.0 -25.0 19.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 1.36 110.803 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.0 -12.62 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.398 -0.364 . . . . 1.51 111.012 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.937 ' N ' HD21 ' A' ' 30' ' ' ASN . . . -65.68 126.7 29.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.429 -0.35 . . . . 1.17 110.821 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 36' ' ' ASN . 11.7 mttt -81.76 71.14 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 2.5 110.079 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.628 ' CG2' ' OD1' ' A' ' 30' ' ' ASN . 2.2 t -39.45 -30.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 1.08 110.154 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.487 ' O ' ' N ' ' A' ' 40' ' ' ASP . 15.1 t-20 -50.53 -38.84 46.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.958 -0.564 . . . . 1.81 109.911 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -62.4 -36.51 82.56 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.477 -0.564 . . . . 1.49 109.477 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.628 ' HE ' ' CD ' ' A' ' 27' ' ' GLU . 22.7 mmt180 -71.57 -47.14 56.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.743 -0.662 . . . . 2.2 109.367 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.763 HG22 ' HD1' ' A' ' 94' ' ' HIS . 25.3 mt -67.06 -36.75 77.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.431 -0.804 . . . . 1.14 109.999 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.487 ' N ' ' O ' ' A' ' 36' ' ' ASN . 62.7 t0 -68.88 -40.02 79.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.034 -0.53 . . . . 1.19 109.719 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.557 ' HG3' ' HZ1' ' A' ' 45' ' ' LYS . 37.9 tp10 -65.22 -49.39 69.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.917 -0.583 . . . . 1.42 109.829 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -63.2 -48.57 77.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.841 -0.618 . . . . 0.46 109.869 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.615 HG21 ' O ' ' A' ' 39' ' ' ILE . 54.1 t -55.79 -53.66 35.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.804 -0.635 . . . . 1.13 110.958 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.5 m -55.3 -53.09 60.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 1.1 111.48 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.626 ' HD2' HD13 ' A' ' 13' ' ' LEU . 7.9 mtmm -65.22 -43.42 91.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.467 -0.333 . . . . 1.91 111.327 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.53 -46.49 73.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.903 0.383 . . . . 1.1 110.163 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 1.013 ' CD2' ' SD ' ' A' ' 98' ' ' MET . 42.6 t80 -66.27 -58.97 4.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.93 110.063 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.459 ' C ' ' H ' ' A' ' 50' ' ' ASP . 53.1 t80 -55.42 -46.72 76.65 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.356 -0.838 . . . . 2.54 111.321 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 45' ' ' LYS . . . -74.17 16.48 0.24 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.48 -0.327 . . . . 1.11 111.165 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.459 ' H ' ' C ' ' A' ' 48' ' ' PHE . 57.8 t0 44.04 40.25 3.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.787 0.327 . . . . 1.35 110.555 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.505 HD11 HG22 ' A' ' 51' ' ' ILE . 2.6 mm -80.7 133.41 29.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 1.16 110.577 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.6 ' OG ' HD22 ' C' ' 431' ' ' LEU . 7.8 m -89.93 151.96 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 1.01 110.318 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.812 ' C ' HD12 ' A' ' 57' ' ' LEU . 20.0 t -55.11 -23.4 13.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.191 -0.458 . . . . 1.07 110.432 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.917 ' OG ' ' HB2' ' C' ' 429' ' ' GLN . 0.3 OUTLIER -46.29 -62.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 1.82 110.587 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 1.021 ' OE1' HD22 ' A' ' 14' ' ' LEU . 54.6 mt-30 -56.73 -42.38 79.15 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.857 -0.337 . . . . 1.65 110.393 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.501 HG23 ' HA ' ' A' ' 53' ' ' VAL . 4.1 t -58.47 -41.37 81.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 108.913 -0.773 . . . . 1.1 108.913 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.827 ' HB3' ' HB3' ' C' ' 422' ' ' ALA . 2.2 mt -73.07 -46.85 49.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.274 -0.875 . . . . 1.09 110.343 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.838 ' CD ' ' HB3' ' C' ' 425' ' ' ALA . 18.7 mt-10 -70.05 -50.53 40.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.055 -0.52 . . . . 1.13 111.216 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.546 ' N ' ' O ' ' A' ' 55' ' ' GLN . 56.2 mt -54.57 -38.07 40.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.616 -0.434 . . . . 1.02 109.931 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.711 ' CE1' ' HB2' ' A' ' 88' ' ' LEU . 43.9 t60 -59.21 -51.16 71.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 1.21 111.007 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 57' ' ' LEU . 28.7 t -52.97 -51.64 36.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.193 -0.458 . . . . 1.08 111.625 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.818 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 0.6 OUTLIER -53.89 -52.57 60.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.578 -0.283 . . . . 1.71 111.582 -178.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.064 HD12 ' CD1' ' D' ' 506' ' ' ILE . 24.4 tp -61.31 -40.77 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.465 -0.494 . . . . 1.15 110.064 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' MET . . . . . 1.059 ' SD ' ' CD2' ' A' ' 84' ' ' TYR . 2.3 mmt -57.42 -41.08 79.68 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.539 -0.541 . . . . 1.49 109.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -62.75 -28.77 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.898 -0.592 . . . . 1.3 109.436 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.59 HG22 HD13 ' D' ' 506' ' ' ILE . 5.5 m -66.83 -41.06 88.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.478 -0.783 . . . . 1.15 110.751 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 1.162 ' CE1' HG22 ' D' ' 506' ' ' ILE . 54.2 m-85 -73.44 -46.52 47.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.98 110.894 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 p -57.8 -41.16 81.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.032 0.444 . . . . 1.95 110.234 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -59.84 -50.75 72.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.743 -0.662 . . . . 2.64 110.663 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 66' ' ' THR . 75.2 mt-30 -60.1 -45.02 94.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 2.66 110.637 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.557 HD13 ' O ' ' A' ' 67' ' ' PHE . 0.2 OUTLIER -51.56 -38.62 55.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.42 -0.355 . . . . 1.15 110.714 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.952 ' HE3' ' OE1' ' C' ' 417' ' ' GLU . 68.4 mttt -71.17 -53.09 15.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.319 -0.4 . . . . 2.69 110.663 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.76 -32.29 73.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 1.48 110.913 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' OE1' ' HD2' ' A' ' 76' ' ' ARG . 95.8 mt-10 -97.81 -4.2 37.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.372 -0.376 . . . . 1.41 110.812 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 71' ' ' LEU . . . 51.51 57.89 11.13 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.402 -1.079 . . . . 0.89 110.402 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.612 ' HB3' ' OG1' ' D' ' 511' ' ' THR . 1.9 mtt180 -118.29 142.75 47.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.707 0.289 . . . . 2.48 111.226 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.476 ' O ' HG22 ' A' ' 80' ' ' ILE . 7.7 t -41.59 113.49 0.42 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.726 -0.472 . . . . 1.42 109.726 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.954 ' OE1' ' OE2' ' C' ' 417' ' ' GLU . 12.1 pt-20 -79.63 -6.3 56.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.346 -0.388 . . . . 1.39 110.633 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.829 ' HB3' ' CG2' ' D' ' 515' ' ' VAL . 70.2 m-20 -53.93 -34.38 59.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.107 -0.497 . . . . 1.78 110.571 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.606 ' CD1' ' HG2' ' D' ' 512' ' ' ARG . 0.8 OUTLIER -52.32 -15.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 1.3 110.781 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 78' ' ' GLU . 2.0 mp -59.27 -20.19 52.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 1.5 111.027 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 1.139 HD12 ' OG1' ' D' ' 519' ' ' THR . 0.4 OUTLIER -60.55 -28.7 68.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 1.73 110.839 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ASP . . . . . 0.876 ' OD1' ' N ' ' A' ' 84' ' ' TYR . 45.4 p-10 -59.22 -45.96 89.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.071 -0.513 . . . . 1.23 110.424 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 1.059 ' CD2' ' SD ' ' A' ' 64' ' ' MET . 8.2 m-85 -58.78 -39.23 80.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 1.06 110.174 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 1.312 HH21 ' NH2' ' B' ' 285' ' ' ARG . 0.0 OUTLIER -66.28 -41.83 89.29 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.287 -0.634 . . . . 3.74 109.287 179.364 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.816 HD23 ' HA ' ' D' ' 521' ' ' LEU . 66.0 mt -69.01 -33.67 74.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.347 0.594 . . . . 1.36 109.523 178.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' THR . . . . . 0.889 ' O ' HG22 ' A' ' 91' ' ' VAL . 25.8 m -77.77 -40.27 41.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.336 -0.847 . . . . 1.09 110.208 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.711 ' HB2' ' CE1' ' A' ' 60' ' ' HIS . 2.9 tm? -67.54 -49.1 64.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 1.09 110.753 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 97.9 mt -68.11 -42.9 85.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 1.06 110.376 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ASP . . . . . 0.816 ' OD1' ' NZ ' ' D' ' 526' ' ' LYS . 47.2 t0 -64.28 -45.7 86.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 1.79 110.547 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . 0.889 HG22 ' O ' ' A' ' 87' ' ' THR . 53.3 t -58.9 -54.03 39.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 1.07 110.497 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.833 ' O ' HD23 ' A' ' 95' ' ' LEU . 72.9 mt -57.68 -43.12 83.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 1.08 110.653 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.402 ' HB1' HD22 ' B' ' 257' ' ' LEU . . . -64.38 -32.3 73.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.988 -0.551 . . . . 1.07 111.271 -179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' HIS . . . . . 0.763 ' HD1' HG22 ' A' ' 39' ' ' ILE . 10.9 t-160 -70.71 -51.25 28.72 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.938 -0.305 . . . . 2.14 111.483 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LEU . . . . . 0.833 HD23 ' O ' ' A' ' 92' ' ' ILE . 0.2 OUTLIER -71.23 -35.52 71.51 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.385 -0.526 . . . . 1.46 110.095 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' CYS . . . . . 0.599 ' N ' ' HG ' ' A' ' 95' ' ' LEU . 28.6 t -60.2 -34.56 73.8 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.056 -0.72 . . . . 1.08 109.056 178.939 -169.895 147.172 -112.658 104.35 2.021 104.298 -71.517 -80.84 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.987 ' OE1' ' HA ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -66.85 -40.73 88.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.68 -0.691 . . . . 1.9 109.517 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' MET . . . . . 1.013 ' SD ' ' CD2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -59.28 -41.57 89.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 1.38 110.084 179.366 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.926 ' N ' ' HG3' ' A' ' 98' ' ' MET . 19.9 m-85 -56.27 -48.79 75.89 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.023 -0.535 . . . . 1.08 110.346 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . 1.042 HH12 HD22 ' D' ' 531' ' ' LEU . 29.8 ttp180 -57.35 -36.49 71.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 3.27 110.993 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 101' ' ' ARG . 56.6 mtt180 -75.02 -29.52 60.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 2.77 110.725 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.39 7.94 3.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 1.85 110.472 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.521 HG13 ' O ' ' A' ' 100' ' ' ARG . 0.2 OUTLIER -106.93 99.07 23.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 1.22 110.831 -179.461 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -68.79 115.49 3.98 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.461 2.107 . . . . 1.28 110.733 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ARG . . . . . 0.636 ' C ' ' OE1' ' A' ' 106' ' ' GLU . 6.6 mmm-85 -119.35 144.28 46.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.329 -0.396 . . . . 4.57 111.522 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLU . . . . . 1.177 ' O ' HG11 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -65.77 173.3 2.93 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.269 -0.423 . . . . 3.8 109.86 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' VAL . . . . . 1.177 HG11 ' O ' ' A' ' 106' ' ' GLU . 4.0 p . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 117.932 -1.032 . . . . 5.82 110.633 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' B' ' 202' ' ' MET . . . . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 108.99 -0.745 . . . . 8.03 108.99 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' MET . . . . . 1.13 ' O ' ' CE ' ' B' ' 202' ' ' MET . 0.0 OUTLIER -37.35 148.3 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.738 -0.838 . . . . 5.47 108.738 178.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' ALA . . . . . 0.844 ' C ' ' HG2' ' B' ' 204' ' ' ARG . . . -42.49 86.4 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 118.357 -1.337 . . . . 4.73 108.243 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' ARG . . . . . 1.027 ' HG3' HH11 ' B' ' 204' ' ' ARG . 0.0 OUTLIER 54.07 20.46 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.639 -0.709 . . . . 8.74 111.426 -179.097 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' MET . . . . . 1.018 ' O ' ' SD ' ' B' ' 202' ' ' MET . 19.4 mtt -81.68 88.98 6.22 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 120.611 -0.435 . . . . 5.51 110.208 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.76 168.27 20.53 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.539 -0.541 . . . . 2.38 109.539 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -67.82 -13.08 37.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 122.193 1.928 . . . . 1.73 111.765 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -72.57 -55.62 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 1.47 110.133 179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' B' ' 212' ' ' LYS . 88.0 m-20 -46.07 -45.89 16.51 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.798 -0.445 . . . . 1.42 109.798 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 210' ' ' LYS . . . . . 0.986 ' HE3' ' OE1' ' D' ' 532' ' ' GLU . 0.1 OUTLIER -59.34 -46.11 89.52 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.446 -0.575 . . . . 2.43 109.446 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 211' ' ' ARG . . . . . 0.628 ' O ' ' HD2' ' B' ' 211' ' ' ARG . 5.0 tpt180 -62.18 -38.49 89.27 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.989 -0.745 . . . . 2.63 108.989 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 212' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' B' ' 209' ' ' ASP . 0.3 OUTLIER -58.65 -44.65 90.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.105 -1.072 . . . . 2.5 108.105 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 213' ' ' LEU . . . . . 0.864 ' O ' ' HG ' ' B' ' 217' ' ' LEU . 0.2 OUTLIER -58.05 -49.26 77.49 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.452 -0.944 . . . . 1.17 108.452 177.794 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 214' ' ' LEU . . . . . 1.019 HD22 ' OE1' ' B' ' 255' ' ' GLN . 47.7 mt -56.66 -44.57 81.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.314 -0.857 . . . . 1.17 109.199 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 215' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -58.57 -38.99 79.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.299 -0.864 . . . . 1.16 109.962 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 216' ' ' GLU . . . . . 0.658 ' O ' HG13 ' B' ' 220' ' ' ILE . 56.4 mt-10 -79.11 -43.96 23.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 1.8 110.161 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 217' ' ' LEU . . . . . 0.864 ' HG ' ' O ' ' B' ' 213' ' ' LEU . 48.9 mt -59.36 -35.82 74.59 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.984 -0.747 . . . . 1.23 108.984 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 218' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' B' ' 214' ' ' LEU . 18.0 ttt180 -61.7 -53.83 50.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.076 -0.966 . . . . 3.76 109.648 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 219' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -43.26 79.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.829 -0.623 . . . . 1.75 110.082 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 220' ' ' ILE . . . . . 0.658 HG13 ' O ' ' B' ' 216' ' ' GLU . 92.9 mt -57.79 -51.47 69.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 N-CA-C 109.552 -0.536 . . . . 1.09 109.552 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 221' ' ' TYR . . . . . 0.408 ' O ' ' HB ' ' B' ' 224' ' ' ILE . 67.9 t80 -53.32 -51.33 62.71 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.356 -0.979 . . . . 0.85 108.356 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 222' ' ' ARG . . . . . 0.431 ' HD2' HG12 ' C' ' 406' ' ' ILE . 22.4 ttp180 -52.8 -50.25 64.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.489 -1.232 . . . . 2.77 110.356 179.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 223' ' ' THR . . . . . 0.464 HG22 ' HD2' ' B' ' 238' ' ' ARG . 81.4 m -55.91 -41.36 74.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.008 -0.542 . . . . 1.07 110.443 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 224' ' ' ILE . . . . . 0.597 HG12 ' CB ' ' B' ' 238' ' ' ARG . 84.1 mt -55.5 -40.14 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 1.09 110.169 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 225' ' ' VAL . . . . . 0.661 HG12 ' CD1' ' B' ' 284' ' ' TYR . 77.6 t -66.63 -49.89 70.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.809 -0.632 . . . . 1.09 111.118 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 226' ' ' LEU . . . . . 0.472 ' CD2' ' HA2' ' C' ' 408' ' ' GLY . 50.9 mt -58.42 -38.64 77.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 1.22 111.352 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 227' ' ' GLU . . . . . 0.631 ' CD ' ' HE ' ' B' ' 238' ' ' ARG . 93.8 mt-10 -88.06 -7.01 57.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.426 -0.352 . . . . 1.05 111.594 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -51.38 -32.43 26.0 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.452 -0.499 . . . . 1.09 110.143 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 229' ' ' PHE . . . . . 1.061 ' HB3' ' NH1' ' C' ' 412' ' ' ARG . 39.4 m-85 -107.41 17.28 22.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.72 110.664 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 230' ' ' ASN . . . . . 0.928 HD21 ' N ' ' B' ' 233' ' ' ALA . 2.3 p-10 -59.74 149.91 29.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 1.1 110.63 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 231' ' ' THR . . . . . . . . . . . . . 35.0 p -90.98 -24.97 19.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 1.36 110.793 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 232' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.09 -12.53 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.367 . . . . 1.51 110.983 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 233' ' ' ALA . . . . . 0.928 ' N ' HD21 ' B' ' 230' ' ' ASN . . . -65.7 126.72 29.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 1.18 110.836 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 234' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' B' ' 236' ' ' ASN . 11.7 mttt -81.77 71.16 8.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 2.51 110.102 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 235' ' ' VAL . . . . . 0.623 ' CG2' ' OD1' ' B' ' 230' ' ' ASN . 2.2 t -39.5 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 1.08 110.141 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 236' ' ' ASN . . . . . 0.501 ' OD1' ' C ' ' B' ' 236' ' ' ASN . 15.0 t-20 -50.56 -38.81 47.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 1.8 109.896 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 237' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -62.36 -36.59 82.7 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.477 -0.564 . . . . 1.49 109.477 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 238' ' ' ARG . . . . . 0.631 ' HE ' ' CD ' ' B' ' 227' ' ' GLU . 22.8 mmt180 -71.55 -47.16 56.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.719 -0.673 . . . . 2.2 109.333 178.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 239' ' ' ILE . . . . . 0.747 HG22 ' HD1' ' B' ' 294' ' ' HIS . 25.3 mt -67.05 -36.7 77.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 1.14 110.045 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 240' ' ' ASP . . . . . 0.493 ' N ' ' O ' ' B' ' 236' ' ' ASN . 62.7 t0 -69.0 -39.96 79.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.973 -0.558 . . . . 1.19 109.713 179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 241' ' ' GLU . . . . . 0.558 ' CG ' ' HZ1' ' B' ' 245' ' ' LYS . 37.9 tp10 -65.14 -49.44 69.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.43 109.86 179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 242' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -63.26 -48.52 77.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.809 -0.632 . . . . 0.47 109.854 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 243' ' ' VAL . . . . . 0.618 HG21 ' O ' ' B' ' 239' ' ' ILE . 54.6 t -55.75 -53.77 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.863 -0.608 . . . . 1.13 110.954 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 244' ' ' SER . . . . . . . . . . . . . 71.0 m -55.25 -53.06 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.966 -0.561 . . . . 1.09 111.488 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 245' ' ' LYS . . . . . 0.618 ' HD2' HD13 ' B' ' 213' ' ' LEU . 7.9 mtmm -65.23 -43.4 91.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.48 -0.327 . . . . 1.91 111.333 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 246' ' ' ALA . . . . . . . . . . . . . . . -54.51 -46.53 73.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.402 . . . . 1.11 110.176 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 247' ' ' PHE . . . . . 1.005 ' CD2' ' SD ' ' B' ' 298' ' ' MET . 42.6 t80 -66.28 -58.95 4.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.93 110.08 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 248' ' ' PHE . . . . . 0.466 ' C ' ' H ' ' B' ' 250' ' ' ASP . 53.1 t80 -55.38 -46.7 76.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.284 -0.871 . . . . 2.54 111.386 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 249' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' B' ' 245' ' ' LYS . . . -74.25 16.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.442 -0.345 . . . . 1.11 111.178 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 250' ' ' ASP . . . . . 0.466 ' H ' ' C ' ' B' ' 248' ' ' PHE . 57.9 t0 44.02 40.29 3.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.82 0.343 . . . . 1.35 110.513 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 251' ' ' ILE . . . . . 0.467 HD11 HG22 ' B' ' 251' ' ' ILE . 2.6 mm -80.76 133.47 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 1.16 110.554 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 252' ' ' SER . . . . . 0.611 ' OG ' HD22 ' D' ' 531' ' ' LEU . 7.8 m -89.92 151.95 21.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 1.01 110.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 253' ' ' VAL . . . . . 0.821 ' C ' HD12 ' B' ' 257' ' ' LEU . 19.9 t -55.19 -23.3 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 1.08 110.463 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 254' ' ' SER . . . . . 0.92 ' OG ' ' HB2' ' D' ' 529' ' ' GLN . 0.3 OUTLIER -46.25 -62.64 1.26 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.19 -0.459 . . . . 1.82 110.612 179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 255' ' ' GLN . . . . . 1.019 ' OE1' HD22 ' B' ' 214' ' ' LEU . 54.6 mt-30 -56.72 -42.38 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.477 -0.328 . . . . 1.65 110.424 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 256' ' ' VAL . . . . . 0.505 HG23 ' HA ' ' B' ' 253' ' ' VAL . 4.1 t -58.5 -41.35 81.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.859 -0.793 . . . . 1.1 108.859 178.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 257' ' ' LEU . . . . . 0.829 ' HB3' ' HB3' ' D' ' 522' ' ' ALA . 2.1 mt -73.09 -46.86 49.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.294 -0.866 . . . . 1.09 110.371 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 258' ' ' GLU . . . . . 0.832 ' CD ' ' HB3' ' D' ' 525' ' ' ALA . 18.7 mt-10 -70.03 -50.49 40.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.012 -0.54 . . . . 1.14 111.23 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 259' ' ' ILE . . . . . 0.496 ' N ' ' O ' ' B' ' 255' ' ' GLN . 56.0 mt -54.62 -38.07 41.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.634 -0.426 . . . . 1.02 109.889 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 260' ' ' HIS . . . . . 0.718 ' CE1' ' HB2' ' B' ' 288' ' ' LEU . 43.8 t60 -59.24 -51.11 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.988 -0.551 . . . . 1.21 111.038 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 261' ' ' VAL . . . . . 0.511 HG21 ' O ' ' B' ' 257' ' ' LEU . 28.5 t -52.9 -51.74 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 1.08 111.664 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 262' ' ' GLU . . . . . 0.849 ' HA ' ' OE1' ' B' ' 262' ' ' GLU . 0.6 OUTLIER -53.88 -52.54 60.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.561 -0.29 . . . . 1.71 111.546 -178.784 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 263' ' ' LEU . . . . . 1.083 HD12 ' CD1' ' C' ' 406' ' ' ILE . 24.5 tp -61.33 -40.76 95.41 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.474 -0.491 . . . . 1.14 110.081 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 264' ' ' MET . . . . . 1.073 ' SD ' ' CD2' ' B' ' 284' ' ' TYR . 2.3 mmt -57.38 -41.11 79.58 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.55 -0.537 . . . . 1.49 109.55 179.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 265' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -62.8 -28.71 70.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.869 -0.605 . . . . 1.3 109.478 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 266' ' ' THR . . . . . 0.562 HG22 HD13 ' C' ' 406' ' ' ILE . 5.4 m -66.8 -41.08 88.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.484 -0.78 . . . . 1.14 110.802 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 267' ' ' PHE . . . . . 1.159 ' CE1' HG22 ' C' ' 406' ' ' ILE . 54.2 m-85 -73.4 -46.58 47.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.97 110.895 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 268' ' ' SER . . . . . . . . . . . . . 5.0 p -57.77 -41.23 81.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.007 0.432 . . . . 1.94 110.189 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 269' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -59.84 -50.69 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.781 -0.645 . . . . 2.64 110.722 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 270' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' B' ' 266' ' ' THR . 75.1 mt-30 -60.06 -45.07 94.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 2.66 110.68 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 271' ' ' LEU . . . . . 0.56 HD13 ' O ' ' B' ' 267' ' ' PHE . 0.2 OUTLIER -51.51 -38.7 55.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 1.15 110.691 179.852 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 272' ' ' LYS . . . . . 0.975 ' HE3' ' OE1' ' D' ' 517' ' ' GLU . 68.3 mttt -71.1 -53.04 15.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 2.69 110.702 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 80.6 mt -63.79 -32.3 73.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 1.48 110.926 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 274' ' ' GLU . . . . . 0.411 ' OE1' ' HD2' ' B' ' 276' ' ' ARG . 95.8 mt-10 -97.88 -4.16 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 1.41 110.724 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 275' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' B' ' 271' ' ' LEU . . . 51.46 57.95 10.92 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.412 -1.075 . . . . 0.89 110.412 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 276' ' ' ARG . . . . . 0.618 ' HB3' ' OG1' ' C' ' 411' ' ' THR . 1.9 mtt180 -118.33 142.72 47.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.647 0.26 . . . . 2.48 111.234 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 277' ' ' SER . . . . . 0.465 ' O ' HG22 ' B' ' 280' ' ' ILE . 7.7 t -41.52 113.48 0.41 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.697 -0.483 . . . . 1.42 109.697 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 278' ' ' GLU . . . . . 0.943 ' OE1' ' OE2' ' D' ' 517' ' ' GLU . 12.0 pt-20 -79.61 -6.39 56.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.849 0.356 . . . . 1.39 110.583 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 279' ' ' ASP . . . . . 0.845 ' HB3' ' CG2' ' C' ' 415' ' ' VAL . 70.3 m-20 -53.94 -34.33 59.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 1.77 110.598 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 280' ' ' ILE . . . . . 0.601 ' CD1' ' HG2' ' C' ' 412' ' ' ARG . 0.8 OUTLIER -52.32 -15.11 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 1.3 110.758 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 281' ' ' LEU . . . . . 0.552 ' HB2' ' O ' ' B' ' 278' ' ' GLU . 2.0 mp -59.15 -20.22 51.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.257 -0.428 . . . . 1.49 111.112 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 282' ' ' LEU . . . . . 1.119 HD12 ' OG1' ' C' ' 419' ' ' THR . 0.4 OUTLIER -60.53 -28.7 68.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.863 0.363 . . . . 1.73 110.834 -179.753 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 283' ' ' ASP . . . . . 0.886 ' OD1' ' N ' ' B' ' 284' ' ' TYR . 45.3 p-10 -59.25 -45.9 89.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 1.23 110.479 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 284' ' ' TYR . . . . . 1.073 ' CD2' ' SD ' ' B' ' 264' ' ' MET . 8.2 m-85 -58.82 -39.18 80.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 1.06 110.179 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 285' ' ' ARG . . . . . 1.312 ' NH2' HH21 ' A' ' 85' ' ' ARG . 0.0 OUTLIER -66.3 -41.83 89.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.316 -0.624 . . . . 3.73 109.316 179.34 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 286' ' ' LEU . . . . . 0.801 HD23 ' HA ' ' C' ' 421' ' ' LEU . 65.7 mt -69.08 -33.54 73.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.408 0.623 . . . . 1.36 109.527 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 287' ' ' THR . . . . . 0.901 ' O ' HG22 ' B' ' 291' ' ' VAL . 26.1 m -77.85 -40.28 40.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.323 -0.853 . . . . 1.09 110.169 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 288' ' ' LEU . . . . . 0.718 ' HB2' ' CE1' ' B' ' 260' ' ' HIS . 2.9 tm? -67.59 -49.06 64.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.797 -0.638 . . . . 1.09 110.794 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 289' ' ' ILE . . . . . . . . . . . . . 98.0 mt -68.13 -42.86 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 1.05 110.444 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 290' ' ' ASP . . . . . 0.809 ' OD1' ' NZ ' ' C' ' 426' ' ' LYS . 47.4 t0 -64.25 -45.72 86.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 1.79 110.575 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 291' ' ' VAL . . . . . 0.901 HG22 ' O ' ' B' ' 287' ' ' THR . 53.2 t -58.87 -54.07 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 1.06 110.51 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 292' ' ' ILE . . . . . 0.836 ' O ' HD23 ' B' ' 295' ' ' LEU . 73.1 mt -57.71 -43.11 83.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 1.08 110.658 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -64.4 -32.17 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.044 -0.526 . . . . 1.06 111.278 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 294' ' ' HIS . . . . . 0.747 ' HD1' HG22 ' B' ' 239' ' ' ILE . 11.0 t-160 -70.81 -51.29 27.68 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.927 -0.309 . . . . 2.14 111.459 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 295' ' ' LEU . . . . . 0.836 HD23 ' O ' ' B' ' 292' ' ' ILE . 0.2 OUTLIER -71.12 -35.56 71.81 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.442 -0.503 . . . . 1.46 109.996 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 296' ' ' CYS . . . . . 0.602 ' N ' ' HG ' ' B' ' 295' ' ' LEU . 19.3 m -59.38 -35.3 73.67 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.098 -0.704 . . . . 0.66 109.098 178.827 -80.84 -71.517 -112.658 104.298 2.021 104.35 147.172 -169.895 2 2 . 1 . 001 nuclear orig full ' B' B ' 297' ' ' GLU . . . . . 0.989 ' OE1' ' HA ' ' B' ' 297' ' ' GLU . 0.0 OUTLIER -67.13 -40.64 86.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 1.9 109.682 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 298' ' ' MET . . . . . 1.005 ' SD ' ' CD2' ' B' ' 247' ' ' PHE . 0.0 OUTLIER -59.36 -41.56 89.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.872 -0.604 . . . . 1.38 110.017 179.391 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 299' ' ' TYR . . . . . 0.966 ' N ' ' HG3' ' B' ' 298' ' ' MET . 20.3 m-85 -56.22 -48.79 75.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 1.08 110.371 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 300' ' ' ARG . . . . . 1.075 HH12 HD22 ' C' ' 431' ' ' LEU . 29.7 ttp180 -57.34 -36.52 71.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.836 -0.62 . . . . 3.28 111.007 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 301' ' ' ARG . . . . . . . . . . . . . 56.6 mtt180 -74.96 -29.6 60.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 2.77 110.75 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 302' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.28 7.94 3.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 1.85 110.449 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 303' ' ' ILE . . . . . 0.518 HG13 ' O ' ' B' ' 300' ' ' ARG . 0.2 OUTLIER -106.99 98.95 23.54 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.188 -0.46 . . . . 1.21 110.801 -179.364 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 304' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -68.62 115.43 3.91 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.544 2.162 . . . . 1.28 110.743 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 305' ' ' ARG . . . . . 0.649 ' C ' ' OE1' ' B' ' 306' ' ' GLU . 6.6 mmm-85 -119.36 144.27 46.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.379 -0.373 . . . . 4.56 111.505 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 306' ' ' GLU . . . . . 1.173 ' O ' HG11 ' B' ' 307' ' ' VAL . 0.0 OUTLIER -65.79 173.27 2.97 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.835 -0.431 . . . . 3.8 109.835 179.397 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 307' ' ' VAL . . . . . 1.173 HG11 ' O ' ' B' ' 306' ' ' GLU . 3.9 p . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.965 -1.017 . . . . 5.82 110.575 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 401' ' ' ALA . . . . . 0.98 ' O ' ' CG ' ' C' ' 402' ' ' MET . . . . . . . . 0 N--CA 1.501 2.11 0 N-CA-C 108.937 -0.764 . . . . 8.19 108.937 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 402' ' ' MET . . . . . 0.98 ' CG ' ' O ' ' C' ' 401' ' ' ALA . 0.0 OUTLIER 135.29 -44.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.666 -1.152 . . . . 9.0 109.729 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 403' ' ' ALA . . . . . 0.787 ' CB ' ' O ' ' C' ' 402' ' ' MET . . . 115.86 -64.61 0.0 OUTLIER 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 120.817 0.341 . . . . 5.63 111.781 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 404' ' ' GLY . . . . . . . . . . . . . . . -57.37 74.33 0.01 OUTLIER Glycine 0 CA--C 1.526 0.723 0 CA-C-N 115.741 -0.663 . . . . 3.38 113.05 -178.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 405' ' ' ILE . . . . . 0.543 HG22 ' O ' ' C' ' 405' ' ' ILE . 0.7 OUTLIER -80.01 95.53 2.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.229 -0.656 . . . . 3.37 109.229 178.08 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 406' ' ' ILE . . . . . 1.159 HG22 ' CE1' ' B' ' 267' ' ' PHE . 32.1 mt -59.03 123.43 11.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.17 0 CA-C-N 115.673 -0.694 . . . . 2.96 111.493 -178.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 407' ' ' SER . . . . . 0.48 ' O ' ' HE1' ' B' ' 267' ' ' PHE . 5.5 t -109.15 -80.65 0.58 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.442 -0.799 . . . . 2.82 109.098 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 408' ' ' GLY . . . . . 1.297 ' O ' ' CG2' ' C' ' 409' ' ' THR . . . 97.94 -45.1 1.73 Allowed Glycine 0 CA--C 1.522 0.521 0 C-N-CA 121.198 -0.525 . . . . 2.36 112.042 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 409' ' ' THR . . . . . 1.297 ' CG2' ' O ' ' C' ' 408' ' ' GLY . 2.3 p 108.69 32.54 0.0 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.244 0.545 . . . . 1.6 109.952 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 410' ' ' PRO . . . . . 0.836 ' CD ' ' N ' ' C' ' 409' ' ' THR . 92.6 Cg_exo -37.81 150.61 0.05 OUTLIER 'Trans proline' 0 C--N 1.298 -2.095 0 C-N-CA 123.344 2.696 . . . . 0.6 112.043 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 411' ' ' THR . . . . . 0.618 ' OG1' ' HB3' ' B' ' 276' ' ' ARG . 0.2 OUTLIER 56.55 60.32 3.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.765 -0.374 . . . . 2.09 110.572 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 412' ' ' ARG . . . . . 1.061 ' NH1' ' HB3' ' B' ' 229' ' ' PHE . 0.0 OUTLIER -133.15 -44.49 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.558 -0.457 . . . . 3.3 111.339 -179.45 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 413' ' ' ILE . . . . . 0.86 ' N ' ' HG3' ' C' ' 412' ' ' ARG . 1.5 tp -100.87 138.63 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.95 0.405 . . . . 1.72 111.413 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 414' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.52 104.01 16.61 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.915 -0.584 . . . . 2.43 109.722 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 415' ' ' VAL . . . . . 1.092 ' CG1' HD11 ' B' ' 282' ' ' LEU . 22.7 m -109.07 147.83 13.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 1.49 111.928 -178.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 416' ' ' ASP . . . . . 0.763 ' O ' ' HB ' ' C' ' 419' ' ' THR . 19.2 t0 -106.9 -175.55 2.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.822 -0.626 . . . . 2.56 109.907 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 417' ' ' GLU . . . . . 0.954 ' OE2' ' OE1' ' A' ' 78' ' ' GLU . 1.4 mt-10 -35.03 -102.31 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.544 -0.298 . . . . 2.06 110.796 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 418' ' ' LYS . . . . . 0.899 ' O ' ' O ' ' C' ' 419' ' ' THR . 2.4 tttt -49.41 2.99 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.878 0.37 . . . . 2.45 110.589 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 419' ' ' THR . . . . . 1.119 ' OG1' HD12 ' B' ' 282' ' ' LEU . 3.1 t 5.47 126.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.097 -0.502 . . . . 2.07 110.761 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 420' ' ' GLU . . . . . 1.112 ' O ' ' O ' ' C' ' 419' ' ' THR . 5.3 mp0 -5.92 155.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.884 -0.598 . . . . 2.31 111.374 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 421' ' ' LEU . . . . . 0.801 ' HA ' HD23 ' B' ' 286' ' ' LEU . 0.3 OUTLIER -158.24 -128.68 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.974 -0.557 . . . . 2.04 110.783 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 422' ' ' ALA . . . . . 0.827 ' HB3' ' HB3' ' A' ' 57' ' ' LEU . . . -72.76 -0.62 13.77 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.912 0.387 . . . . 1.14 110.872 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 423' ' ' ARG . . . . . 0.811 ' HE ' ' HG3' ' C' ' 420' ' ' GLU . 0.0 OUTLIER -36.38 -23.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.042 -0.526 . . . . 2.73 111.437 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 424' ' ' ILE . . . . . 1.304 ' O ' ' N ' ' C' ' 426' ' ' LYS . 36.5 pt -70.95 8.92 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.515 -0.311 . . . . 1.67 111.392 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 425' ' ' ALA . . . . . 0.838 ' HB3' ' CD ' ' A' ' 58' ' ' GLU . . . 36.06 -45.28 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.276 -0.569 . . . . 1.42 109.619 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 426' ' ' LYS . . . . . 1.304 ' N ' ' O ' ' C' ' 424' ' ' ILE . 38.4 tptt 98.56 0.3 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.091 -0.504 . . . . 2.75 110.987 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 427' ' ' GLY . . . . . . . . . . . . . . . 71.09 16.15 74.83 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.357 -1.097 . . . . 1.37 110.357 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 428' ' ' MET . . . . . 0.893 ' HE1' ' HG2' ' C' ' 426' ' ' LYS . 8.4 mtt -89.34 -40.01 13.06 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.76 0.314 . . . . 2.61 110.894 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 429' ' ' GLN . . . . . 0.917 ' HB2' ' OG ' ' A' ' 54' ' ' SER . 35.6 tt0 -60.33 45.94 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.295 0.85 . . . . 2.61 113.295 -178.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 430' ' ' ASP . . . . . 0.554 ' N ' ' O ' ' C' ' 428' ' ' MET . 3.5 t0 -110.63 -11.76 14.4 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.769 -1.197 . . . . 2.17 107.769 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 431' ' ' LEU . . . . . 1.075 HD22 HH12 ' B' ' 300' ' ' ARG . 0.0 OUTLIER -50.87 77.8 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 112.891 -1.959 . . . . 2.7 115.958 -177.554 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 432' ' ' GLU . . . . . 0.954 ' OE1' ' HE3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER 151.28 -85.75 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 116.268 1.951 . . . . 4.47 116.268 175.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 433' ' ' SER . . . . . 0.579 ' HA ' ' OE1' ' C' ' 434' ' ' GLU . 0.5 OUTLIER -20.62 149.96 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 115.412 1.634 . . . . 5.79 115.412 -175.69 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' C' C ' 434' ' ' GLU . . . . . 1.111 ' N ' ' OE1' ' C' ' 434' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.348 0.521 0 CA-C-N 114.898 -1.046 . . . . 7.56 110.084 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 501' ' ' ALA . . . . . 0.988 ' O ' ' HG2' ' D' ' 502' ' ' MET . . . . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 108.872 -0.788 . . . . 8.2 108.872 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 502' ' ' MET . . . . . 0.988 ' HG2' ' O ' ' D' ' 501' ' ' ALA . 0.0 OUTLIER 135.1 -44.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.58 -1.191 . . . . 8.99 109.934 179.594 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 503' ' ' ALA . . . . . 0.778 ' CB ' ' O ' ' D' ' 502' ' ' MET . . . 115.52 -64.54 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.801 0.334 . . . . 5.63 111.878 178.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 504' ' ' GLY . . . . . . . . . . . . . . . -57.44 74.19 0.01 OUTLIER Glycine 0 CA--C 1.526 0.764 0 CA-C-N 115.81 -0.632 . . . . 3.4 113.201 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 505' ' ' ILE . . . . . 0.551 HG22 ' O ' ' D' ' 505' ' ' ILE . 0.7 OUTLIER -79.84 95.33 2.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.363 -0.606 . . . . 3.38 109.363 178.134 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 506' ' ' ILE . . . . . 1.162 HG22 ' CE1' ' A' ' 67' ' ' PHE . 31.6 mt -58.81 123.42 10.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.757 -0.656 . . . . 2.95 111.463 -178.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 507' ' ' SER . . . . . 0.469 ' O ' ' HE1' ' A' ' 67' ' ' PHE . 5.5 t -109.2 -80.59 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.436 -0.802 . . . . 2.81 109.133 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 508' ' ' GLY . . . . . 1.311 ' O ' ' CG2' ' D' ' 509' ' ' THR . . . 97.84 -44.92 1.76 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 116.055 -0.52 . . . . 2.36 112.026 178.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 509' ' ' THR . . . . . 1.311 ' CG2' ' O ' ' D' ' 508' ' ' GLY . 2.4 p 108.63 32.58 0.0 OUTLIER Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 121.279 0.562 . . . . 1.6 109.956 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 510' ' ' PRO . . . . . 0.839 ' CD ' ' N ' ' D' ' 509' ' ' THR . 91.9 Cg_exo -37.85 150.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.299 -2.05 0 C-N-CA 123.326 2.684 . . . . 0.6 112.078 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 511' ' ' THR . . . . . 0.612 ' OG1' ' HB3' ' A' ' 76' ' ' ARG . 0.2 OUTLIER 56.56 60.37 3.13 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.764 -0.375 . . . . 2.08 110.547 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 512' ' ' ARG . . . . . 1.093 ' NH1' ' HB3' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -133.18 -44.48 0.85 Allowed 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.559 -0.456 . . . . 3.3 111.363 -179.465 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 513' ' ' ILE . . . . . 0.86 ' N ' ' HG3' ' D' ' 512' ' ' ARG . 1.5 tp -100.91 138.63 24.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.969 0.414 . . . . 1.72 111.439 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 514' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.5 103.97 16.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.949 -0.569 . . . . 2.42 109.744 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 515' ' ' VAL . . . . . 1.086 ' CG1' HD11 ' A' ' 82' ' ' LEU . 22.8 m -109.05 147.84 13.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.049 -0.523 . . . . 1.49 111.902 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 516' ' ' ASP . . . . . 0.77 ' O ' ' HB ' ' D' ' 519' ' ' THR . 19.2 t0 -106.87 -175.6 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.785 -0.643 . . . . 2.56 109.905 178.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 517' ' ' GLU . . . . . 0.975 ' OE1' ' HE3' ' B' ' 272' ' ' LYS . 1.4 mt-10 -34.99 -102.3 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.541 -0.299 . . . . 2.07 110.785 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 518' ' ' LYS . . . . . 0.896 ' O ' ' O ' ' D' ' 519' ' ' THR . 2.3 tttt -49.45 3.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 2.44 110.534 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 519' ' ' THR . . . . . 1.139 ' OG1' HD12 ' A' ' 82' ' ' LEU . 3.0 t 5.47 126.41 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.081 -0.508 . . . . 2.06 110.728 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 520' ' ' GLU . . . . . 1.103 ' O ' ' O ' ' D' ' 519' ' ' THR . 5.3 mp0 -5.97 155.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.877 -0.601 . . . . 2.32 111.35 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 521' ' ' LEU . . . . . 0.816 ' HA ' HD23 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -158.21 -128.67 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.968 -0.56 . . . . 2.03 110.785 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 522' ' ' ALA . . . . . 0.829 ' HB3' ' HB3' ' B' ' 257' ' ' LEU . . . -72.76 -0.62 13.77 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.3 -0.409 . . . . 1.15 110.879 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 523' ' ' ARG . . . . . 0.827 ' HE ' ' HG3' ' D' ' 520' ' ' GLU . 0.0 OUTLIER -36.37 -23.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 2.73 111.441 -179.709 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 524' ' ' ILE . . . . . 1.32 ' O ' ' N ' ' D' ' 526' ' ' LYS . 36.9 pt -71.05 9.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.575 -0.284 . . . . 1.68 111.353 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 525' ' ' ALA . . . . . 0.832 ' HB3' ' CD ' ' B' ' 258' ' ' GLU . . . 36.0 -45.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.253 -0.579 . . . . 1.42 109.636 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 526' ' ' LYS . . . . . 1.32 ' N ' ' O ' ' D' ' 524' ' ' ILE . 38.4 tptt 98.59 0.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.134 -0.485 . . . . 2.74 110.967 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 527' ' ' GLY . . . . . . . . . . . . . . . 71.12 16.07 74.84 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.406 -1.078 . . . . 1.37 110.406 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' D' D ' 528' ' ' MET . . . . . 0.886 ' HE1' ' HG2' ' D' ' 526' ' ' LYS . 8.3 mtt -89.21 -40.08 13.1 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.766 0.317 . . . . 2.61 110.923 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 529' ' ' GLN . . . . . 0.92 ' HB2' ' OG ' ' B' ' 254' ' ' SER . 35.6 tt0 -60.28 45.8 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.314 0.857 . . . . 2.61 113.314 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 530' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' D' ' 528' ' ' MET . 3.5 t0 -110.45 -11.76 14.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.83 -1.174 . . . . 2.17 107.83 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' D' D ' 531' ' ' LEU . . . . . 1.042 HD22 HH12 ' A' ' 100' ' ' ARG . 0.0 OUTLIER -50.89 77.78 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 112.945 -1.934 . . . . 2.7 115.859 -177.429 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 532' ' ' GLU . . . . . 0.986 ' OE1' ' HE3' ' B' ' 210' ' ' LYS . 0.1 OUTLIER 151.29 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.277 1.954 . . . . 4.47 116.277 175.748 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 533' ' ' SER . . . . . 0.59 ' HA ' ' OE1' ' D' ' 534' ' ' GLU . 0.5 OUTLIER -20.47 149.86 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.48 1.659 . . . . 5.78 115.48 -175.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' D' D ' 534' ' ' GLU . . . . . 1.11 ' OE1' ' N ' ' D' ' 534' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.348 0.53 0 CA-C-N 114.925 -1.034 . . . . 7.56 110.094 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.48 ' O ' ' C ' ' A' ' 2' ' ' MET . . . . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 109.022 -0.733 . . . . 7.6600000000000001 109.022 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . 1.281 ' O ' ' HE2' ' A' ' 2' ' ' MET . 0.0 OUTLIER -37.37 148.38 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.74 -0.837 . . . . 5.46 108.74 178.906 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.845 ' O ' ' HG2' ' A' ' 4' ' ' ARG . . . -42.54 86.37 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 118.345 -1.342 . . . . 4.4199999999999999 108.284 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.023 HH11 ' HG3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER 54.07 20.58 2.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.677 -0.692 . . . . 8.0199999999999996 111.382 -179.099 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . 1.059 ' H ' ' HE2' ' A' ' 2' ' ' MET . 19.1 mtt -81.8 89.0 6.28 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.602 -0.439 . . . . 5.0899999999999999 110.164 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.4 ' CB ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -85.73 168.33 20.27 Favored Pre-proline 0 C--N 1.331 -0.198 0 C-N-CA 120.371 -0.532 . . . . 2.2000000000000002 109.575 179.141 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 6' ' ' SER . 17.8 Cg_endo -67.87 -13.07 37.41 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.147 1.898 . . . . 1.4399999999999999 111.749 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.58 -55.59 6.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.94999999999999996 110.121 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' A' ' 12' ' ' LYS . 88.1 m-20 -46.09 -45.84 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.815 -0.439 . . . . 1.4099999999999999 109.815 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.976 ' HE3' ' OE1' ' C' ' 432' ' ' GLU . 0.1 OUTLIER -59.35 -46.17 89.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.43 -0.581 . . . . 1.8300000000000001 109.43 179.155 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.639 ' HD2' ' O ' ' A' ' 11' ' ' ARG . 5.0 tpt180 -62.09 -38.51 89.12 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.033 -0.729 . . . . 1.97 109.033 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.3 OUTLIER -58.61 -44.64 89.97 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.096 -1.076 . . . . 1.99 108.096 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.87 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -58.13 -49.23 77.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.456 -0.942 . . . . 0.46000000000000002 108.456 177.826 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.903 HD22 ' OE1' ' A' ' 55' ' ' GLN . 47.4 mt -56.64 -44.57 81.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.265 -0.879 . . . . 0.55000000000000004 109.239 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -58.55 -39.05 79.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.264 -0.88 . . . . 1.1599999999999999 109.942 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.648 ' O ' HG13 ' A' ' 20' ' ' ILE . 56.4 mt-10 -79.08 -43.94 23.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 1.79 110.144 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.87 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 48.6 mt -59.39 -35.84 74.7 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.97 -0.752 . . . . 0.53000000000000003 108.97 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 14' ' ' LEU . 18.0 ttt180 -61.67 -53.81 51.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.086 -0.961 . . . . 3.0499999999999998 109.7 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.26 79.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.84 -0.618 . . . . 1.1499999999999999 110.056 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.648 HG13 ' O ' ' A' ' 16' ' ' GLU . 93.2 mt -57.83 -51.4 70.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 109.608 -0.515 . . . . 0.34999999999999998 109.608 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.776 ' HA ' HD12 ' A' ' 24' ' ' ILE . 67.8 t80 -53.34 -51.32 62.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.404 -0.962 . . . . 0.40000000000000002 108.404 178.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.454 ' HD2' HG12 ' D' ' 506' ' ' ILE . 22.4 ttp180 -52.77 -50.32 63.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.5 -1.227 . . . . 2.1499999999999999 110.309 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . 0.453 ' CG2' ' HD2' ' A' ' 38' ' ' ARG . 81.2 m -55.85 -41.46 74.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.018 -0.537 . . . . 0.23999999999999999 110.381 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 21' ' ' TYR . 84.0 mt -55.44 -40.13 56.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.29999999999999999 110.195 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.521 HG11 ' CE1' ' A' ' 84' ' ' TYR . 78.2 t -66.64 -49.91 70.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.34999999999999998 111.134 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.637 HD23 ' HA2' ' D' ' 508' ' ' GLY . 51.2 mt -58.45 -38.65 77.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.55000000000000004 111.272 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.667 ' CD ' ' HE ' ' A' ' 38' ' ' ARG . 93.8 mt-10 -88.12 -6.94 57.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.452 -0.34 . . . . 1.04 111.574 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -51.3 -32.47 25.16 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.464 -0.495 . . . . 0.55000000000000004 110.219 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 1.116 ' HB3' ' NH1' ' D' ' 512' ' ' ARG . 39.5 m-85 -107.43 17.3 22.94 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.981 -0.554 . . . . 0.63 110.638 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.989 ' CB ' ' HB3' ' A' ' 33' ' ' ALA . 7.1 p30 -59.73 149.92 29.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.77000000000000002 110.675 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.9 p -91.0 -25.0 19.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.78000000000000003 110.803 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.0 -12.62 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.398 -0.364 . . . . 1.51 111.012 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.989 ' HB3' ' CB ' ' A' ' 30' ' ' ASN . . . -65.68 126.7 29.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.429 -0.35 . . . . 1.1699999999999999 110.821 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 36' ' ' ASN . 11.7 mttt -81.76 71.14 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 1.9299999999999999 110.079 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.778 ' CG2' ' ND2' ' A' ' 30' ' ' ASN . 2.2 t -39.45 -30.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 0.35999999999999999 110.154 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.487 ' C ' ' OD1' ' A' ' 36' ' ' ASN . 15.1 t-20 -50.53 -38.84 46.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.958 -0.564 . . . . 1.22 109.911 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -62.4 -36.51 82.56 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.477 -0.564 . . . . 1.49 109.477 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.667 ' HE ' ' CD ' ' A' ' 27' ' ' GLU . 22.7 mmt180 -71.57 -47.14 56.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.743 -0.662 . . . . 1.72 109.367 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.758 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.3 mt -67.06 -36.75 77.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.431 -0.804 . . . . 0.33000000000000002 109.999 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 36' ' ' ASN . 62.7 t0 -68.88 -40.02 79.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.034 -0.53 . . . . 1.1899999999999999 109.719 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -65.22 -49.39 69.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.917 -0.583 . . . . 1.4199999999999999 109.829 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -63.2 -48.57 77.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.841 -0.618 . . . . 0.38 109.869 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 39' ' ' ILE . 54.1 t -55.79 -53.66 35.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.804 -0.635 . . . . 0.34000000000000002 110.958 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.5 m -55.3 -53.09 60.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.40999999999999998 111.48 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.54 ' CE ' ' CD1' ' A' ' 20' ' ' ILE . 7.9 mtmm -65.22 -43.42 91.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.467 -0.333 . . . . 1.3600000000000001 111.327 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.53 -46.49 73.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.903 0.383 . . . . 0.34999999999999998 110.163 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 1.013 ' CD2' ' SD ' ' A' ' 98' ' ' MET . 42.6 t80 -66.27 -58.97 4.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.69999999999999996 110.063 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.419 ' C ' ' H ' ' A' ' 50' ' ' ASP . 53.1 t80 -55.42 -46.72 76.65 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.356 -0.838 . . . . 2.02 111.321 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.17 16.48 0.24 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.48 -0.327 . . . . 0.46999999999999997 111.165 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 48' ' ' PHE . 57.8 t0 44.04 40.25 3.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.787 0.327 . . . . 1.3500000000000001 110.555 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.6 mm -80.7 133.41 29.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.53000000000000003 110.577 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.759 ' OG ' HD23 ' C' ' 431' ' ' LEU . 7.8 m -89.93 151.96 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.41999999999999998 110.318 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.741 HG12 ' CG ' ' A' ' 57' ' ' LEU . 20.0 t -55.11 -23.4 13.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.191 -0.458 . . . . 0.28000000000000003 110.432 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.907 ' OG ' ' HB2' ' C' ' 429' ' ' GLN . 0.3 OUTLIER -46.29 -62.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 1.24 110.587 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.903 ' OE1' HD22 ' A' ' 14' ' ' LEU . 54.6 mt-30 -56.73 -42.38 79.15 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.857 -0.337 . . . . 1.24 110.393 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.41 HG23 ' H ' ' A' ' 56' ' ' VAL . 4.1 t -58.47 -41.37 81.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 108.913 -0.773 . . . . 0.23999999999999999 108.913 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 1.08 ' HB3' ' HB1' ' C' ' 422' ' ' ALA . 2.2 mt -73.07 -46.85 49.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.274 -0.875 . . . . 0.25 110.343 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.818 ' OE2' ' HB2' ' C' ' 425' ' ' ALA . 18.7 mt-10 -70.05 -50.53 40.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.055 -0.52 . . . . 1.1299999999999999 111.216 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 55' ' ' GLN . 56.2 mt -54.57 -38.07 40.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.616 -0.434 . . . . 0.26000000000000001 109.931 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.725 ' CE1' ' HB2' ' A' ' 88' ' ' LEU . 43.9 t60 -59.21 -51.16 71.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.98999999999999999 111.007 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 57' ' ' LEU . 28.7 t -52.97 -51.64 36.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.193 -0.458 . . . . 0.28999999999999998 111.625 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.809 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 0.6 OUTLIER -53.89 -52.57 60.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.578 -0.283 . . . . 1.71 111.582 -178.832 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.115 ' CD1' HD13 ' D' ' 506' ' ' ILE . 24.4 tp -61.31 -40.77 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.465 -0.494 . . . . 0.40999999999999998 110.064 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' MET . . . . . 1.059 ' SD ' ' CD2' ' A' ' 84' ' ' TYR . 2.3 mmt -57.42 -41.08 79.68 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.539 -0.541 . . . . 1.1399999999999999 109.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -62.75 -28.77 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.898 -0.592 . . . . 1.3 109.436 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.972 HG21 HD12 ' D' ' 506' ' ' ILE . 5.5 m -66.83 -41.06 88.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.478 -0.783 . . . . 0.42999999999999999 110.751 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 1.137 ' CE1' HG22 ' D' ' 506' ' ' ILE . 54.2 m-85 -73.44 -46.52 47.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.77000000000000002 110.894 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 p -57.8 -41.16 81.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.032 0.444 . . . . 1.4299999999999999 110.234 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -59.84 -50.75 72.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.743 -0.662 . . . . 2.1800000000000002 110.663 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 66' ' ' THR . 75.2 mt-30 -60.1 -45.02 94.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 2.0800000000000001 110.637 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 78' ' ' GLU . 0.2 OUTLIER -51.56 -38.62 55.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.42 -0.355 . . . . 0.64000000000000001 110.714 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.975 ' HE3' ' OE1' ' C' ' 417' ' ' GLU . 68.4 mttt -71.17 -53.09 15.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.319 -0.4 . . . . 2.1899999999999999 110.663 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.76 -32.29 73.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.91000000000000003 110.913 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.426 ' OE1' ' HD2' ' A' ' 76' ' ' ARG . 95.8 mt-10 -97.81 -4.2 37.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.372 -0.376 . . . . 1.4099999999999999 110.812 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 71' ' ' LEU . . . 51.51 57.89 11.13 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.402 -1.079 . . . . 0.75 110.402 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.612 ' HB3' ' OG1' ' D' ' 511' ' ' THR . 1.9 mtt180 -118.29 142.75 47.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.707 0.289 . . . . 1.96 111.226 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.418 ' O ' HG22 ' A' ' 80' ' ' ILE . 7.7 t -41.59 113.49 0.42 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.726 -0.472 . . . . 1.4199999999999999 109.726 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.954 ' OE1' ' OE2' ' C' ' 417' ' ' GLU . 12.1 pt-20 -79.63 -6.3 56.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.346 -0.388 . . . . 1.3899999999999999 110.633 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.846 ' HB3' ' CG2' ' D' ' 515' ' ' VAL . 70.2 m-20 -53.93 -34.38 59.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.107 -0.497 . . . . 1.78 110.571 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.666 HD13 ' HA ' ' D' ' 510' ' ' PRO . 0.8 OUTLIER -52.32 -15.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 0.68999999999999995 110.781 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 78' ' ' GLU . 2.0 mp -59.27 -20.19 52.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.89000000000000001 111.027 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 1.011 ' CD1' ' OG1' ' D' ' 519' ' ' THR . 0.4 OUTLIER -60.55 -28.7 68.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 1.1599999999999999 110.839 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ASP . . . . . 0.876 ' OD1' ' N ' ' A' ' 84' ' ' TYR . 45.4 p-10 -59.22 -45.96 89.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.071 -0.513 . . . . 1.23 110.424 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 1.059 ' CD2' ' SD ' ' A' ' 64' ' ' MET . 8.2 m-85 -58.78 -39.23 80.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.57999999999999996 110.174 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 1.43 ' NH2' ' NH2' ' B' ' 285' ' ' ARG . 0.0 OUTLIER -66.28 -41.83 89.29 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.287 -0.634 . . . . 3.04 109.287 179.364 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.865 HD21 ' CA ' ' D' ' 521' ' ' LEU . 66.0 mt -69.01 -33.67 74.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.347 0.594 . . . . 0.67000000000000004 109.523 178.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' THR . . . . . 0.819 ' O ' HG23 ' A' ' 91' ' ' VAL . 25.8 m -77.77 -40.27 41.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.33000000000000002 110.208 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.734 HD13 ' C ' ' A' ' 88' ' ' LEU . 2.9 tm? -67.54 -49.1 64.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 0.29999999999999999 110.753 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.408 HD12 ' CD2' ' D' ' 521' ' ' LEU . 97.9 mt -68.11 -42.9 85.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 0.23000000000000001 110.376 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ASP . . . . . 0.803 ' OD1' ' NZ ' ' D' ' 526' ' ' LYS . 47.2 t0 -64.28 -45.7 86.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 1.79 110.547 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 87' ' ' THR . 53.3 t -58.9 -54.03 39.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.23000000000000001 110.497 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.698 ' O ' HD23 ' A' ' 95' ' ' LEU . 72.9 mt -57.68 -43.12 83.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.29999999999999999 110.653 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.3 73.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.988 -0.551 . . . . 0.20999999999999999 111.271 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' HIS . . . . . 0.735 ' ND1' HG21 ' A' ' 43' ' ' VAL . 10.9 t-160 -70.71 -51.25 28.72 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.938 -0.305 . . . . 1.3 111.483 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 92' ' ' ILE . 0.2 OUTLIER -71.23 -35.52 71.51 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.385 -0.526 . . . . 0.82999999999999996 110.095 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' CYS . . . . . 0.608 ' N ' ' HG ' ' A' ' 95' ' ' LEU . 28.6 t -60.2 -34.56 73.8 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.056 -0.72 . . . . 1.0800000000000001 109.056 178.939 -169.895 147.172 -112.658 104.35 2.021 104.298 -71.517 -80.84 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.981 ' HA ' ' OE1' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -66.85 -40.73 88.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.68 -0.691 . . . . 1.8999999999999999 109.517 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' MET . . . . . 1.013 ' SD ' ' CD2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -59.28 -41.57 89.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 1.28 110.084 179.366 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.934 ' N ' ' HG3' ' A' ' 98' ' ' MET . 19.9 m-85 -56.27 -48.79 75.89 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.023 -0.535 . . . . 0.73999999999999999 110.346 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . 0.964 HH22 ' CD2' ' D' ' 531' ' ' LEU . 29.8 ttp180 -57.35 -36.49 71.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 2.5800000000000001 110.993 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.466 HH11 ' HD3' ' A' ' 101' ' ' ARG . 56.6 mtt180 -75.02 -29.52 60.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 2.2000000000000002 110.725 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.39 7.94 3.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 1.3500000000000001 110.472 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 100' ' ' ARG . 0.2 OUTLIER -106.93 99.07 23.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 0.70999999999999996 110.831 -179.461 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -68.79 115.49 3.98 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.461 2.107 . . . . 1.28 110.733 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ARG . . . . . 0.636 ' C ' ' OE1' ' A' ' 106' ' ' GLU . 6.6 mmm-85 -119.35 144.28 46.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.329 -0.396 . . . . 3.8599999999999999 111.522 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLU . . . . . 1.279 ' O ' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -65.77 173.3 2.93 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.269 -0.423 . . . . 3.3799999999999999 109.86 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' VAL . . . . . 1.279 HG12 ' O ' ' A' ' 106' ' ' GLU . 4.0 p . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 117.932 -1.032 . . . . 5.4400000000000004 110.633 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 201' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' B' ' 202' ' ' MET . . . . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 108.99 -0.745 . . . . 7.6699999999999999 108.99 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 202' ' ' MET . . . . . 1.148 ' HE2' ' O ' ' B' ' 202' ' ' MET . 0.0 OUTLIER -37.35 148.3 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.738 -0.838 . . . . 5.4699999999999998 108.738 178.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 203' ' ' ALA . . . . . 0.843 ' O ' ' HG2' ' B' ' 204' ' ' ARG . . . -42.49 86.4 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 118.357 -1.337 . . . . 4.4199999999999999 108.243 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 204' ' ' ARG . . . . . 1.031 HH11 ' HG3' ' B' ' 204' ' ' ARG . 0.0 OUTLIER 54.07 20.46 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.639 -0.709 . . . . 8.0299999999999994 111.426 -179.097 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 205' ' ' MET . . . . . 1.129 ' N ' ' HE2' ' B' ' 202' ' ' MET . 19.4 mtt -81.68 88.98 6.22 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 120.611 -0.435 . . . . 5.0899999999999999 110.208 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.76 168.27 20.53 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.539 -0.541 . . . . 2.2000000000000002 109.539 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -67.82 -13.08 37.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 122.193 1.928 . . . . 1.45 111.765 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -72.57 -55.62 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.94999999999999996 110.133 179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 209' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' B' ' 212' ' ' LYS . 88.0 m-20 -46.07 -45.89 16.51 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.798 -0.445 . . . . 1.4199999999999999 109.798 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 210' ' ' LYS . . . . . 1.003 ' HE3' ' OE1' ' D' ' 532' ' ' GLU . 0.1 OUTLIER -59.34 -46.11 89.52 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.446 -0.575 . . . . 1.8300000000000001 109.446 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 211' ' ' ARG . . . . . 0.638 ' HD2' ' O ' ' B' ' 211' ' ' ARG . 5.0 tpt180 -62.18 -38.49 89.27 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.989 -0.745 . . . . 1.97 108.989 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 212' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' B' ' 209' ' ' ASP . 0.3 OUTLIER -58.65 -44.65 90.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.105 -1.072 . . . . 2.0099999999999998 108.105 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 213' ' ' LEU . . . . . 0.87 ' O ' ' HG ' ' B' ' 217' ' ' LEU . 0.2 OUTLIER -58.05 -49.26 77.49 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.452 -0.944 . . . . 0.46000000000000002 108.452 177.794 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 214' ' ' LEU . . . . . 0.902 HD22 ' OE1' ' B' ' 255' ' ' GLN . 47.7 mt -56.66 -44.57 81.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.56000000000000005 109.199 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 215' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -58.57 -38.99 79.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.299 -0.864 . . . . 1.1599999999999999 109.962 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 216' ' ' GLU . . . . . 0.646 ' O ' HG13 ' B' ' 220' ' ' ILE . 56.4 mt-10 -79.11 -43.96 23.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 1.8 110.161 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 217' ' ' LEU . . . . . 0.87 ' HG ' ' O ' ' B' ' 213' ' ' LEU . 48.9 mt -59.36 -35.82 74.59 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.984 -0.747 . . . . 0.54000000000000004 108.984 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 218' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' B' ' 214' ' ' LEU . 18.0 ttt180 -61.7 -53.83 50.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.076 -0.966 . . . . 3.0499999999999998 109.648 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 219' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -43.26 79.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.829 -0.623 . . . . 1.1499999999999999 110.082 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 220' ' ' ILE . . . . . 0.646 HG13 ' O ' ' B' ' 216' ' ' GLU . 92.9 mt -57.79 -51.47 69.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 N-CA-C 109.552 -0.536 . . . . 0.34999999999999998 109.552 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 221' ' ' TYR . . . . . 0.786 ' HA ' HD12 ' B' ' 224' ' ' ILE . 67.9 t80 -53.32 -51.33 62.71 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.356 -0.979 . . . . 0.40000000000000002 108.356 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 222' ' ' ARG . . . . . 0.466 ' HD2' HG12 ' C' ' 406' ' ' ILE . 22.4 ttp180 -52.8 -50.25 64.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.489 -1.232 . . . . 2.1600000000000001 110.356 179.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 223' ' ' THR . . . . . 0.442 ' CG2' ' HD2' ' B' ' 238' ' ' ARG . 81.4 m -55.91 -41.36 74.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.008 -0.542 . . . . 0.23000000000000001 110.443 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 224' ' ' ILE . . . . . 0.786 HD12 ' HA ' ' B' ' 221' ' ' TYR . 84.1 mt -55.5 -40.14 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 0.29999999999999999 110.169 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 225' ' ' VAL . . . . . 0.506 HG11 ' CE1' ' B' ' 284' ' ' TYR . 77.6 t -66.63 -49.89 70.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.809 -0.632 . . . . 0.34999999999999998 111.118 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 226' ' ' LEU . . . . . 0.625 HD23 ' HA2' ' C' ' 408' ' ' GLY . 50.9 mt -58.42 -38.64 77.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.55000000000000004 111.352 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 227' ' ' GLU . . . . . 0.667 ' CD ' ' HE ' ' B' ' 238' ' ' ARG . 93.8 mt-10 -88.06 -7.01 57.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.426 -0.352 . . . . 1.05 111.594 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -51.38 -32.43 26.0 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.452 -0.499 . . . . 0.55000000000000004 110.143 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 229' ' ' PHE . . . . . 1.081 ' HB3' ' NH1' ' C' ' 412' ' ' ARG . 39.4 m-85 -107.41 17.28 22.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.63 110.664 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 230' ' ' ASN . . . . . 0.984 ' CB ' ' HB3' ' B' ' 233' ' ' ALA . 7.1 p30 -59.74 149.91 29.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.76000000000000001 110.63 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 231' ' ' THR . . . . . . . . . . . . . 35.0 p -90.98 -24.97 19.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.79000000000000004 110.793 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 232' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.09 -12.53 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.367 . . . . 1.51 110.983 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 233' ' ' ALA . . . . . 0.984 ' HB3' ' CB ' ' B' ' 230' ' ' ASN . . . -65.7 126.72 29.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 1.1799999999999999 110.836 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 234' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' B' ' 236' ' ' ASN . 11.7 mttt -81.77 71.16 8.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 1.9299999999999999 110.102 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 235' ' ' VAL . . . . . 0.775 ' CG2' ' ND2' ' B' ' 230' ' ' ASN . 2.2 t -39.5 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 0.35999999999999999 110.141 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 236' ' ' ASN . . . . . 0.501 ' OD1' ' C ' ' B' ' 236' ' ' ASN . 15.0 t-20 -50.56 -38.81 47.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 1.23 109.896 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 237' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -62.36 -36.59 82.7 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.477 -0.564 . . . . 1.49 109.477 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 238' ' ' ARG . . . . . 0.667 ' HE ' ' CD ' ' B' ' 227' ' ' GLU . 22.8 mmt180 -71.55 -47.16 56.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.719 -0.673 . . . . 1.72 109.333 178.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 239' ' ' ILE . . . . . 0.763 ' O ' HG23 ' B' ' 243' ' ' VAL . 25.3 mt -67.05 -36.7 77.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 0.33000000000000002 110.045 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 240' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' B' ' 236' ' ' ASN . 62.7 t0 -69.0 -39.96 79.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.973 -0.558 . . . . 1.1899999999999999 109.713 179.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 241' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -65.14 -49.44 69.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.4299999999999999 109.86 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 242' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -63.26 -48.52 77.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.809 -0.632 . . . . 0.38 109.854 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 243' ' ' VAL . . . . . 0.763 HG23 ' O ' ' B' ' 239' ' ' ILE . 54.6 t -55.75 -53.77 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.863 -0.608 . . . . 0.34000000000000002 110.954 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 244' ' ' SER . . . . . . . . . . . . . 71.0 m -55.25 -53.06 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.966 -0.561 . . . . 0.40999999999999998 111.488 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 245' ' ' LYS . . . . . 0.528 ' CE ' ' CD1' ' B' ' 220' ' ' ILE . 7.9 mtmm -65.23 -43.4 91.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.48 -0.327 . . . . 1.3500000000000001 111.333 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 246' ' ' ALA . . . . . . . . . . . . . . . -54.51 -46.53 73.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.402 . . . . 0.34999999999999998 110.176 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 247' ' ' PHE . . . . . 1.005 ' CD2' ' SD ' ' B' ' 298' ' ' MET . 42.6 t80 -66.28 -58.95 4.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.69999999999999996 110.08 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 248' ' ' PHE . . . . . 0.432 ' C ' ' H ' ' B' ' 250' ' ' ASP . 53.1 t80 -55.38 -46.7 76.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.284 -0.871 . . . . 2.02 111.386 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 249' ' ' ALA . . . . . . . . . . . . . . . -74.25 16.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.442 -0.345 . . . . 0.46999999999999997 111.178 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 250' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' B' ' 248' ' ' PHE . 57.9 t0 44.02 40.29 3.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.82 0.343 . . . . 1.3500000000000001 110.513 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 251' ' ' ILE . . . . . . . . . . . . . 2.6 mm -80.76 133.47 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.52000000000000002 110.554 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 252' ' ' SER . . . . . 0.762 ' OG ' HD23 ' D' ' 531' ' ' LEU . 7.8 m -89.92 151.95 21.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.41999999999999998 110.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 253' ' ' VAL . . . . . 0.749 HG12 ' CG ' ' B' ' 257' ' ' LEU . 19.9 t -55.19 -23.3 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.28000000000000003 110.463 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 254' ' ' SER . . . . . 0.899 ' OG ' ' HB2' ' D' ' 529' ' ' GLN . 0.3 OUTLIER -46.25 -62.64 1.26 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.19 -0.459 . . . . 1.24 110.612 179.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 255' ' ' GLN . . . . . 0.902 ' OE1' HD22 ' B' ' 214' ' ' LEU . 54.6 mt-30 -56.72 -42.38 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.477 -0.328 . . . . 1.23 110.424 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 256' ' ' VAL . . . . . . . . . . . . . 4.1 t -58.5 -41.35 81.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.859 -0.793 . . . . 0.23999999999999999 108.859 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 257' ' ' LEU . . . . . 1.04 ' HB3' ' HB1' ' D' ' 522' ' ' ALA . 2.1 mt -73.09 -46.86 49.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.294 -0.866 . . . . 0.26000000000000001 110.371 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 258' ' ' GLU . . . . . 0.806 ' OE2' ' HB2' ' D' ' 525' ' ' ALA . 18.7 mt-10 -70.03 -50.49 40.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.012 -0.54 . . . . 1.1399999999999999 111.23 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 259' ' ' ILE . . . . . 0.496 ' N ' ' O ' ' B' ' 255' ' ' GLN . 56.0 mt -54.62 -38.07 41.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.634 -0.426 . . . . 0.26000000000000001 109.889 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 260' ' ' HIS . . . . . 0.734 ' CE1' ' HB2' ' B' ' 288' ' ' LEU . 43.8 t60 -59.24 -51.11 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.988 -0.551 . . . . 0.98999999999999999 111.038 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 261' ' ' VAL . . . . . 0.575 HG23 ' O ' ' B' ' 257' ' ' LEU . 28.5 t -52.9 -51.74 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.28999999999999998 111.664 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 262' ' ' GLU . . . . . 0.847 ' HA ' ' OE1' ' B' ' 262' ' ' GLU . 0.6 OUTLIER -53.88 -52.54 60.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.561 -0.29 . . . . 1.71 111.546 -178.784 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 263' ' ' LEU . . . . . 1.121 ' CD1' HD13 ' C' ' 406' ' ' ILE . 24.5 tp -61.33 -40.76 95.41 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.474 -0.491 . . . . 0.40999999999999998 110.081 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 264' ' ' MET . . . . . 1.073 ' SD ' ' CD2' ' B' ' 284' ' ' TYR . 2.3 mmt -57.38 -41.11 79.58 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.55 -0.537 . . . . 1.1399999999999999 109.55 179.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 265' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -62.8 -28.71 70.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.869 -0.605 . . . . 1.3 109.478 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 266' ' ' THR . . . . . 1.023 HG21 HD12 ' C' ' 406' ' ' ILE . 5.4 m -66.8 -41.08 88.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.484 -0.78 . . . . 0.41999999999999998 110.802 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 267' ' ' PHE . . . . . 1.125 ' CE1' HG22 ' C' ' 406' ' ' ILE . 54.2 m-85 -73.4 -46.58 47.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.77000000000000002 110.895 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 268' ' ' SER . . . . . . . . . . . . . 5.0 p -57.77 -41.23 81.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.007 0.432 . . . . 1.4299999999999999 110.189 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 269' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -59.84 -50.69 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.781 -0.645 . . . . 2.1800000000000002 110.722 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 270' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' B' ' 266' ' ' THR . 75.1 mt-30 -60.06 -45.07 94.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 2.0899999999999999 110.68 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 271' ' ' LEU . . . . . 0.595 HD23 ' HA ' ' B' ' 278' ' ' GLU . 0.2 OUTLIER -51.51 -38.7 55.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.64000000000000001 110.691 179.852 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 272' ' ' LYS . . . . . 0.997 ' HE3' ' OE1' ' D' ' 517' ' ' GLU . 68.3 mttt -71.1 -53.04 15.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 2.1899999999999999 110.702 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 80.6 mt -63.79 -32.3 73.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 0.91000000000000003 110.926 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 274' ' ' GLU . . . . . 0.426 ' OE1' ' HD2' ' B' ' 276' ' ' ARG . 95.8 mt-10 -97.88 -4.16 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 1.4099999999999999 110.724 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 275' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' B' ' 271' ' ' LEU . . . 51.46 57.95 10.92 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.412 -1.075 . . . . 0.76000000000000001 110.412 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 276' ' ' ARG . . . . . 0.623 ' HB3' ' OG1' ' C' ' 411' ' ' THR . 1.9 mtt180 -118.33 142.72 47.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.647 0.26 . . . . 1.96 111.234 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 277' ' ' SER . . . . . 0.42 ' O ' HG22 ' B' ' 280' ' ' ILE . 7.7 t -41.52 113.48 0.41 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.697 -0.483 . . . . 1.4199999999999999 109.697 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 278' ' ' GLU . . . . . 0.943 ' OE1' ' OE2' ' D' ' 517' ' ' GLU . 12.0 pt-20 -79.61 -6.39 56.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.849 0.356 . . . . 1.3899999999999999 110.583 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 279' ' ' ASP . . . . . 0.861 ' HB3' ' CG2' ' C' ' 415' ' ' VAL . 70.3 m-20 -53.94 -34.33 59.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 1.77 110.598 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 280' ' ' ILE . . . . . 0.677 HD13 ' HA ' ' C' ' 410' ' ' PRO . 0.8 OUTLIER -52.32 -15.11 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.68999999999999995 110.758 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 281' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' B' ' 278' ' ' GLU . 2.0 mp -59.15 -20.22 51.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.257 -0.428 . . . . 0.88 111.112 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 282' ' ' LEU . . . . . 0.986 ' CD1' ' OG1' ' C' ' 419' ' ' THR . 0.4 OUTLIER -60.53 -28.7 68.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.863 0.363 . . . . 1.1699999999999999 110.834 -179.753 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 283' ' ' ASP . . . . . 0.886 ' OD1' ' N ' ' B' ' 284' ' ' TYR . 45.3 p-10 -59.25 -45.9 89.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 1.23 110.479 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 284' ' ' TYR . . . . . 1.073 ' CD2' ' SD ' ' B' ' 264' ' ' MET . 8.2 m-85 -58.82 -39.18 80.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.57999999999999996 110.179 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 285' ' ' ARG . . . . . 1.43 ' NH2' ' NH2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -66.3 -41.83 89.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.316 -0.624 . . . . 3.0299999999999998 109.316 179.34 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 286' ' ' LEU . . . . . 0.848 HD21 ' CA ' ' C' ' 421' ' ' LEU . 65.7 mt -69.08 -33.54 73.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.408 0.623 . . . . 0.67000000000000004 109.527 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 287' ' ' THR . . . . . 0.815 ' O ' HG23 ' B' ' 291' ' ' VAL . 26.1 m -77.85 -40.28 40.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.323 -0.853 . . . . 0.33000000000000002 110.169 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 288' ' ' LEU . . . . . 0.738 HD13 ' C ' ' B' ' 288' ' ' LEU . 2.9 tm? -67.59 -49.06 64.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.797 -0.638 . . . . 0.29999999999999999 110.794 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 289' ' ' ILE . . . . . . . . . . . . . 98.0 mt -68.13 -42.86 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 0.23000000000000001 110.444 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 290' ' ' ASP . . . . . 0.809 ' OD1' ' NZ ' ' C' ' 426' ' ' LYS . 47.4 t0 -64.25 -45.72 86.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 1.79 110.575 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 291' ' ' VAL . . . . . 0.815 HG23 ' O ' ' B' ' 287' ' ' THR . 53.2 t -58.87 -54.07 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.23000000000000001 110.51 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 292' ' ' ILE . . . . . 0.694 ' O ' HD23 ' B' ' 295' ' ' LEU . 73.1 mt -57.71 -43.11 83.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.29999999999999999 110.658 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -64.4 -32.17 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.044 -0.526 . . . . 0.20999999999999999 111.278 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 294' ' ' HIS . . . . . 0.734 ' ND1' HG21 ' B' ' 243' ' ' VAL . 11.0 t-160 -70.81 -51.29 27.68 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.927 -0.309 . . . . 1.3 111.459 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 295' ' ' LEU . . . . . 0.694 HD23 ' O ' ' B' ' 292' ' ' ILE . 0.2 OUTLIER -71.12 -35.56 71.81 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.442 -0.503 . . . . 0.82999999999999996 109.996 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 296' ' ' CYS . . . . . 0.61 ' N ' ' HG ' ' B' ' 295' ' ' LEU . 19.3 m -59.38 -35.3 73.67 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.098 -0.704 . . . . 0.66000000000000003 109.098 178.827 -80.84 -71.517 -112.658 104.298 2.021 104.35 147.172 -169.895 2 2 . 1 . 001 nuclear build full ' B' B ' 297' ' ' GLU . . . . . 0.991 ' HA ' ' OE1' ' B' ' 297' ' ' GLU . 0.0 OUTLIER -67.13 -40.64 86.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 1.8999999999999999 109.682 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 298' ' ' MET . . . . . 1.005 ' SD ' ' CD2' ' B' ' 247' ' ' PHE . 0.0 OUTLIER -59.36 -41.56 89.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.872 -0.604 . . . . 1.28 110.017 179.391 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 299' ' ' TYR . . . . . 0.968 ' N ' ' HG3' ' B' ' 298' ' ' MET . 20.3 m-85 -56.22 -48.79 75.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 0.73999999999999999 110.371 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 300' ' ' ARG . . . . . 0.948 HH22 ' CD2' ' C' ' 431' ' ' LEU . 29.7 ttp180 -57.34 -36.52 71.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.836 -0.62 . . . . 2.5899999999999999 111.007 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 301' ' ' ARG . . . . . 0.422 ' HD3' HH11 ' B' ' 301' ' ' ARG . 56.6 mtt180 -74.96 -29.6 60.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 2.21 110.75 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 302' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.28 7.94 3.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 1.3500000000000001 110.449 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 303' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 300' ' ' ARG . 0.2 OUTLIER -106.99 98.95 23.54 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.188 -0.46 . . . . 0.71999999999999997 110.801 -179.364 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 304' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -68.62 115.43 3.91 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.544 2.162 . . . . 1.28 110.743 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 305' ' ' ARG . . . . . 0.649 ' C ' ' OE1' ' B' ' 306' ' ' GLU . 6.6 mmm-85 -119.36 144.27 46.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.379 -0.373 . . . . 3.8599999999999999 111.505 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 306' ' ' GLU . . . . . 1.27 ' O ' HG12 ' B' ' 307' ' ' VAL . 0.0 OUTLIER -65.79 173.27 2.97 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.835 -0.431 . . . . 3.3799999999999999 109.835 179.397 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 307' ' ' VAL . . . . . 1.27 HG12 ' O ' ' B' ' 306' ' ' GLU . 3.9 p . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.965 -1.017 . . . . 5.4500000000000002 110.575 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 401' ' ' ALA . . . . . 0.98 ' O ' ' CG ' ' C' ' 402' ' ' MET . . . . . . . . 0 N--CA 1.501 2.11 0 N-CA-C 108.937 -0.764 . . . . 7.8799999999999999 108.937 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 402' ' ' MET . . . . . 0.98 ' CG ' ' O ' ' C' ' 401' ' ' ALA . 0.0 OUTLIER 135.29 -44.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.666 -1.152 . . . . 8.6899999999999995 109.729 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 403' ' ' ALA . . . . . 0.787 ' CB ' ' O ' ' C' ' 402' ' ' MET . . . 115.86 -64.61 0.0 OUTLIER 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 120.817 0.341 . . . . 5.2000000000000002 111.781 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 404' ' ' GLY . . . . . . . . . . . . . . . -57.37 74.33 0.01 OUTLIER Glycine 0 CA--C 1.526 0.723 0 CA-C-N 115.741 -0.663 . . . . 3.0800000000000001 113.05 -178.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 405' ' ' ILE . . . . . 0.749 HG22 ' O ' ' C' ' 405' ' ' ILE . 0.7 OUTLIER -80.01 95.53 2.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.229 -0.656 . . . . 2.9100000000000001 109.229 178.08 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 406' ' ' ILE . . . . . 1.125 HG22 ' CE1' ' B' ' 267' ' ' PHE . 32.1 mt -59.03 123.43 11.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.17 0 CA-C-N 115.673 -0.694 . . . . 2.52 111.493 -178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 407' ' ' SER . . . . . 0.481 ' O ' ' HE1' ' B' ' 267' ' ' PHE . 5.5 t -109.15 -80.65 0.58 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.442 -0.799 . . . . 2.4700000000000002 109.098 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 408' ' ' GLY . . . . . 1.297 ' O ' ' CG2' ' C' ' 409' ' ' THR . . . 97.94 -45.1 1.73 Allowed Glycine 0 CA--C 1.522 0.521 0 C-N-CA 121.198 -0.525 . . . . 2.3599999999999999 112.042 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 409' ' ' THR . . . . . 1.297 ' CG2' ' O ' ' C' ' 408' ' ' GLY . 2.3 p 108.69 32.54 0.0 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.244 0.545 . . . . 1.1399999999999999 109.952 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 410' ' ' PRO . . . . . 0.87 ' CD ' ' H ' ' C' ' 409' ' ' THR . 92.6 Cg_exo -37.81 150.61 0.05 OUTLIER 'Trans proline' 0 C--N 1.298 -2.095 0 C-N-CA 123.344 2.696 . . . . 0.56999999999999995 112.043 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 411' ' ' THR . . . . . 0.623 ' OG1' ' HB3' ' B' ' 276' ' ' ARG . 0.2 OUTLIER 56.55 60.32 3.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.765 -0.374 . . . . 1.6100000000000001 110.572 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 412' ' ' ARG . . . . . 1.081 ' NH1' ' HB3' ' B' ' 229' ' ' PHE . 0.0 OUTLIER -133.15 -44.49 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.558 -0.457 . . . . 2.6800000000000002 111.339 -179.45 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 413' ' ' ILE . . . . . 0.856 ' N ' ' HG3' ' C' ' 412' ' ' ARG . 1.5 tp -100.87 138.63 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.95 0.405 . . . . 1.1000000000000001 111.413 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 414' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.52 104.01 16.61 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.915 -0.584 . . . . 1.9399999999999999 109.722 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 415' ' ' VAL . . . . . 0.87 ' CG1' HD13 ' B' ' 282' ' ' LEU . 22.7 m -109.07 147.83 13.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 1.24 111.928 -178.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 416' ' ' ASP . . . . . 0.77 ' O ' ' HB ' ' C' ' 419' ' ' THR . 19.2 t0 -106.9 -175.55 2.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.822 -0.626 . . . . 2.5600000000000001 109.907 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 417' ' ' GLU . . . . . 0.975 ' OE1' ' HE3' ' A' ' 72' ' ' LYS . 1.4 mt-10 -35.03 -102.31 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.544 -0.298 . . . . 2.0600000000000001 110.796 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 418' ' ' LYS . . . . . 0.899 ' O ' ' O ' ' C' ' 419' ' ' THR . 2.4 tttt -49.41 2.99 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.878 0.37 . . . . 1.97 110.589 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 419' ' ' THR . . . . . 1.112 ' O ' ' O ' ' C' ' 420' ' ' GLU . 3.1 t 5.47 126.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.097 -0.502 . . . . 1.4199999999999999 110.761 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 420' ' ' GLU . . . . . 1.112 ' O ' ' O ' ' C' ' 419' ' ' THR . 5.3 mp0 -5.92 155.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.884 -0.598 . . . . 2.3100000000000001 111.374 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 421' ' ' LEU . . . . . 0.848 ' CA ' HD21 ' B' ' 286' ' ' LEU . 0.3 OUTLIER -158.24 -128.68 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.974 -0.557 . . . . 1.47 110.783 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 422' ' ' ALA . . . . . 1.08 ' HB1' ' HB3' ' A' ' 57' ' ' LEU . . . -72.76 -0.62 13.77 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.912 0.387 . . . . 1.1399999999999999 110.872 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 423' ' ' ARG . . . . . 0.868 ' HE ' ' HG3' ' C' ' 420' ' ' GLU . 0.0 OUTLIER -36.38 -23.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.042 -0.526 . . . . 2.2200000000000002 111.437 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 424' ' ' ILE . . . . . 1.304 ' O ' ' N ' ' C' ' 426' ' ' LYS . 36.5 pt -70.95 8.92 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.515 -0.311 . . . . 1.4299999999999999 111.392 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 425' ' ' ALA . . . . . 0.818 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . . . 36.06 -45.28 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.276 -0.569 . . . . 0.79000000000000004 109.619 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 426' ' ' LYS . . . . . 1.304 ' N ' ' O ' ' C' ' 424' ' ' ILE . 38.4 tptt 98.56 0.3 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.091 -0.504 . . . . 2.2799999999999998 110.987 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 427' ' ' GLY . . . . . . . . . . . . . . . 71.09 16.15 74.83 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.357 -1.097 . . . . 1.3700000000000001 110.357 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 428' ' ' MET . . . . . 0.653 ' CE ' ' HG2' ' C' ' 426' ' ' LYS . 8.4 mtt -89.34 -40.01 13.06 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.76 0.314 . . . . 2.1000000000000001 110.894 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 429' ' ' GLN . . . . . 0.907 ' HB2' ' OG ' ' A' ' 54' ' ' SER . 35.6 tt0 -60.33 45.94 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.295 0.85 . . . . 2.0899999999999999 113.295 -178.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 430' ' ' ASP . . . . . 0.554 ' N ' ' O ' ' C' ' 428' ' ' MET . 3.5 t0 -110.63 -11.76 14.4 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.769 -1.197 . . . . 2.1699999999999999 107.769 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 431' ' ' LEU . . . . . 0.948 ' CD2' HH22 ' B' ' 300' ' ' ARG . 0.0 OUTLIER -50.87 77.8 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 112.891 -1.959 . . . . 2.7000000000000002 115.958 -177.554 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 432' ' ' GLU . . . . . 0.976 ' OE1' ' HE3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER 151.28 -85.75 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 116.268 1.951 . . . . 4.4699999999999998 116.268 175.809 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 433' ' ' SER . . . . . 0.598 ' HA ' ' OE1' ' C' ' 434' ' ' GLU . 0.5 OUTLIER -20.62 149.96 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 115.412 1.634 . . . . 5.6900000000000004 115.412 -175.69 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 434' ' ' GLU . . . . . 1.111 ' OE1' ' N ' ' C' ' 434' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.348 0.521 0 CA-C-N 114.898 -1.046 . . . . 7.3799999999999999 110.084 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 501' ' ' ALA . . . . . 0.985 ' O ' ' HG2' ' D' ' 502' ' ' MET . . . . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 108.872 -0.788 . . . . 7.8799999999999999 108.872 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 502' ' ' MET . . . . . 0.985 ' HG2' ' O ' ' D' ' 501' ' ' ALA . 0.0 OUTLIER 135.1 -44.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.58 -1.191 . . . . 8.6899999999999995 109.934 179.594 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 503' ' ' ALA . . . . . 0.778 ' CB ' ' O ' ' D' ' 502' ' ' MET . . . 115.52 -64.54 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.801 0.334 . . . . 5.2000000000000002 111.878 178.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 504' ' ' GLY . . . . . . . . . . . . . . . -57.44 74.19 0.01 OUTLIER Glycine 0 CA--C 1.526 0.764 0 CA-C-N 115.81 -0.632 . . . . 3.1000000000000001 113.201 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 505' ' ' ILE . . . . . 0.742 HG22 ' O ' ' D' ' 505' ' ' ILE . 0.7 OUTLIER -79.84 95.33 2.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.363 -0.606 . . . . 2.9199999999999999 109.363 178.134 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 506' ' ' ILE . . . . . 1.137 HG22 ' CE1' ' A' ' 67' ' ' PHE . 31.6 mt -58.81 123.42 10.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.757 -0.656 . . . . 2.5 111.463 -178.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 507' ' ' SER . . . . . 0.47 ' O ' ' HE1' ' A' ' 67' ' ' PHE . 5.5 t -109.2 -80.59 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.436 -0.802 . . . . 2.4500000000000002 109.133 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 508' ' ' GLY . . . . . 1.311 ' O ' ' CG2' ' D' ' 509' ' ' THR . . . 97.84 -44.92 1.76 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 116.055 -0.52 . . . . 2.3599999999999999 112.026 178.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 509' ' ' THR . . . . . 1.311 ' CG2' ' O ' ' D' ' 508' ' ' GLY . 2.4 p 108.63 32.58 0.0 OUTLIER Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 121.279 0.562 . . . . 1.1399999999999999 109.956 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 510' ' ' PRO . . . . . 0.883 ' CD ' ' H ' ' D' ' 509' ' ' THR . 91.9 Cg_exo -37.85 150.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.299 -2.05 0 C-N-CA 123.326 2.684 . . . . 0.56999999999999995 112.078 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 511' ' ' THR . . . . . 0.612 ' OG1' ' HB3' ' A' ' 76' ' ' ARG . 0.2 OUTLIER 56.56 60.37 3.13 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.764 -0.375 . . . . 1.6000000000000001 110.547 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 512' ' ' ARG . . . . . 1.116 ' NH1' ' HB3' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -133.18 -44.48 0.85 Allowed 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.559 -0.456 . . . . 2.6800000000000002 111.363 -179.465 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 513' ' ' ILE . . . . . 0.858 ' N ' ' HG3' ' D' ' 512' ' ' ARG . 1.5 tp -100.91 138.63 24.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.969 0.414 . . . . 1.1000000000000001 111.439 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 514' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.5 103.97 16.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.949 -0.569 . . . . 1.9299999999999999 109.744 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 515' ' ' VAL . . . . . 0.855 ' CG1' HD13 ' A' ' 82' ' ' LEU . 22.8 m -109.05 147.84 13.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.049 -0.523 . . . . 1.23 111.902 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 516' ' ' ASP . . . . . 0.775 ' O ' ' HB ' ' D' ' 519' ' ' THR . 19.2 t0 -106.87 -175.6 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.785 -0.643 . . . . 2.5600000000000001 109.905 178.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 517' ' ' GLU . . . . . 0.997 ' OE1' ' HE3' ' B' ' 272' ' ' LYS . 1.4 mt-10 -34.99 -102.3 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.541 -0.299 . . . . 2.0699999999999998 110.785 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 518' ' ' LYS . . . . . 0.896 ' O ' ' O ' ' D' ' 519' ' ' THR . 2.3 tttt -49.45 3.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 1.96 110.534 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 519' ' ' THR . . . . . 1.103 ' O ' ' O ' ' D' ' 520' ' ' GLU . 3.0 t 5.47 126.41 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.081 -0.508 . . . . 1.4199999999999999 110.728 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 520' ' ' GLU . . . . . 1.103 ' O ' ' O ' ' D' ' 519' ' ' THR . 5.3 mp0 -5.97 155.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.877 -0.601 . . . . 2.3199999999999998 111.35 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 521' ' ' LEU . . . . . 0.865 ' CA ' HD21 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -158.21 -128.67 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.968 -0.56 . . . . 1.47 110.785 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 522' ' ' ALA . . . . . 1.04 ' HB1' ' HB3' ' B' ' 257' ' ' LEU . . . -72.76 -0.62 13.77 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.3 -0.409 . . . . 1.1499999999999999 110.879 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 523' ' ' ARG . . . . . 0.878 ' HE ' ' HG3' ' D' ' 520' ' ' GLU . 0.0 OUTLIER -36.37 -23.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 2.2200000000000002 111.441 -179.709 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 524' ' ' ILE . . . . . 1.32 ' O ' ' N ' ' D' ' 526' ' ' LYS . 36.9 pt -71.05 9.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.575 -0.284 . . . . 1.4299999999999999 111.353 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 525' ' ' ALA . . . . . 0.806 ' HB2' ' OE2' ' B' ' 258' ' ' GLU . . . 36.0 -45.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.253 -0.579 . . . . 0.79000000000000004 109.636 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 526' ' ' LYS . . . . . 1.32 ' N ' ' O ' ' D' ' 524' ' ' ILE . 38.4 tptt 98.59 0.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.134 -0.485 . . . . 2.2799999999999998 110.967 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 527' ' ' GLY . . . . . . . . . . . . . . . 71.12 16.07 74.84 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.406 -1.078 . . . . 1.3700000000000001 110.406 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' D' D ' 528' ' ' MET . . . . . 0.668 ' CE ' ' HG2' ' D' ' 526' ' ' LYS . 8.3 mtt -89.21 -40.08 13.1 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.766 0.317 . . . . 2.1000000000000001 110.923 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 529' ' ' GLN . . . . . 0.899 ' HB2' ' OG ' ' B' ' 254' ' ' SER . 35.6 tt0 -60.28 45.8 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.314 0.857 . . . . 2.0800000000000001 113.314 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 530' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' D' ' 528' ' ' MET . 3.5 t0 -110.45 -11.76 14.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.83 -1.174 . . . . 2.1699999999999999 107.83 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' D' D ' 531' ' ' LEU . . . . . 0.964 ' CD2' HH22 ' A' ' 100' ' ' ARG . 0.0 OUTLIER -50.89 77.78 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 112.945 -1.934 . . . . 2.7000000000000002 115.859 -177.429 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 532' ' ' GLU . . . . . 1.003 ' OE1' ' HE3' ' B' ' 210' ' ' LYS . 0.1 OUTLIER 151.29 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.277 1.954 . . . . 4.4699999999999998 116.277 175.748 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 533' ' ' SER . . . . . 0.611 ' HA ' ' OE1' ' D' ' 534' ' ' GLU . 0.5 OUTLIER -20.47 149.86 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.48 1.659 . . . . 5.6900000000000004 115.48 -175.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' D' D ' 534' ' ' GLU . . . . . 1.11 ' OE1' ' N ' ' D' ' 534' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.348 0.53 0 CA-C-N 114.925 -1.034 . . . . 7.3799999999999999 110.094 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.48 ' O ' ' C ' ' A' ' 2' ' ' MET . . . . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 109.022 -0.733 . . . . 7.66 109.022 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 1.281 ' HE2' ' O ' ' A' ' 2' ' ' MET . 0.0 OUTLIER -37.37 148.38 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.74 -0.837 . . . . 5.46 108.74 178.906 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.845 ' O ' ' HG2' ' A' ' 4' ' ' ARG . . . -42.54 86.37 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 118.345 -1.342 . . . . 4.42 108.284 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.023 HH11 ' HG3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER 54.07 20.58 2.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.677 -0.692 . . . . 8.02 111.382 -179.099 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . 1.059 ' H ' ' HE2' ' A' ' 2' ' ' MET . 19.1 mtt -81.8 89.0 6.28 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 120.602 -0.439 . . . . 5.09 110.164 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.4 ' CB ' ' HD2' ' A' ' 7' ' ' PRO . 0.0 OUTLIER -85.73 168.33 20.27 Favored Pre-proline 0 C--N 1.331 -0.198 0 C-N-CA 120.371 -0.532 . . . . 2.2 109.575 179.141 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 6' ' ' SER . 17.8 Cg_endo -67.87 -13.07 37.41 Favored 'Trans proline' 0 C--N 1.303 -1.863 0 C-N-CA 122.147 1.898 . . . . 1.44 111.749 -179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.58 -55.59 6.67 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.95 110.121 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.413 ' O ' ' HB3' ' A' ' 12' ' ' LYS . 88.1 m-20 -46.09 -45.84 16.56 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.815 -0.439 . . . . 1.41 109.815 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.976 ' HE3' ' OE1' ' C' ' 432' ' ' GLU . 0.1 OUTLIER -59.35 -46.17 89.37 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.43 -0.581 . . . . 1.83 109.43 179.155 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.639 ' O ' ' HD2' ' A' ' 11' ' ' ARG . 5.0 tpt180 -62.09 -38.51 89.12 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 109.033 -0.729 . . . . 1.97 109.033 178.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.413 ' HB3' ' O ' ' A' ' 9' ' ' ASP . 0.3 OUTLIER -58.61 -44.64 89.97 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 108.096 -1.076 . . . . 1.99 108.096 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.87 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.2 OUTLIER -58.13 -49.23 77.7 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.456 -0.942 . . . . 0.46 108.456 177.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.903 HD22 ' OE1' ' A' ' 55' ' ' GLN . 47.4 mt -56.64 -44.57 81.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.265 -0.879 . . . . 0.55 109.239 178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -58.55 -39.05 79.16 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.264 -0.88 . . . . 1.16 109.942 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.648 ' O ' HG13 ' A' ' 20' ' ' ILE . 56.4 mt-10 -79.08 -43.94 23.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.625 -0.716 . . . . 1.79 110.144 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.87 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 48.6 mt -59.39 -35.84 74.7 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.97 -0.752 . . . . 0.53 108.97 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 14' ' ' LEU . 18.0 ttt180 -61.67 -53.81 51.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.086 -0.961 . . . . 3.05 109.7 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.99 -43.26 79.33 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.84 -0.618 . . . . 1.15 110.056 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.648 HG13 ' O ' ' A' ' 16' ' ' GLU . 93.2 mt -57.83 -51.4 70.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 109.608 -0.515 . . . . 0.35 109.608 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.776 ' HA ' HD12 ' A' ' 24' ' ' ILE . 67.8 t80 -53.34 -51.32 62.81 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.404 -0.962 . . . . 0.4 108.404 178.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.454 ' HD2' HG12 ' D' ' 506' ' ' ILE . 22.4 ttp180 -52.77 -50.32 63.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.5 -1.227 . . . . 2.15 110.309 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . 0.453 ' CG2' ' HD2' ' A' ' 38' ' ' ARG . 81.2 m -55.85 -41.46 74.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.018 -0.537 . . . . 0.24 110.381 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.776 HD12 ' HA ' ' A' ' 21' ' ' TYR . 84.0 mt -55.44 -40.13 56.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.197 -0.456 . . . . 0.3 110.195 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.521 HG11 ' CE1' ' A' ' 84' ' ' TYR . 78.2 t -66.64 -49.91 70.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.772 -0.649 . . . . 0.35 111.134 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.637 HD23 ' HA2' ' D' ' 508' ' ' GLY . 51.2 mt -58.45 -38.65 77.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.232 -0.44 . . . . 0.55 111.272 -179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.667 ' CD ' ' HE ' ' A' ' 38' ' ' ARG . 93.8 mt-10 -88.12 -6.94 57.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.452 -0.34 . . . . 1.04 111.574 -179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 31.2 t80 -51.3 -32.47 25.16 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.464 -0.495 . . . . 0.55 110.219 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 1.116 ' HB3' ' NH1' ' D' ' 512' ' ' ARG . 39.5 m-85 -107.43 17.3 22.94 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.981 -0.554 . . . . 0.63 110.638 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.989 ' CB ' ' HB3' ' A' ' 33' ' ' ALA . 2.3 p-10 -59.73 149.92 29.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.224 -0.444 . . . . 0.77 110.675 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 34.9 p -91.0 -25.0 19.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.78 110.803 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.0 -12.62 1.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.398 -0.364 . . . . 1.51 111.012 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.989 ' HB3' ' CB ' ' A' ' 30' ' ' ASN . . . -65.68 126.7 29.23 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.429 -0.35 . . . . 1.17 110.821 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.415 ' O ' ' N ' ' A' ' 36' ' ' ASN . 11.7 mttt -81.76 71.14 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.147 -0.479 . . . . 1.93 110.079 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.628 ' CG2' ' OD1' ' A' ' 30' ' ' ASN . 2.2 t -39.45 -30.93 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.12 -0.491 . . . . 0.36 110.154 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.487 ' OD1' ' C ' ' A' ' 36' ' ' ASN . 15.1 t-20 -50.53 -38.84 46.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.958 -0.564 . . . . 1.22 109.911 179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -62.4 -36.51 82.56 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.477 -0.564 . . . . 1.49 109.477 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.667 ' HE ' ' CD ' ' A' ' 27' ' ' GLU . 22.7 mmt180 -71.57 -47.14 56.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.743 -0.662 . . . . 1.72 109.367 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.758 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.3 mt -67.06 -36.75 77.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.431 -0.804 . . . . 0.33 109.999 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.432 ' N ' ' O ' ' A' ' 36' ' ' ASN . 62.7 t0 -68.88 -40.02 79.48 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.034 -0.53 . . . . 1.19 109.719 179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -65.22 -49.39 69.85 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.917 -0.583 . . . . 1.42 109.829 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -63.2 -48.57 77.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.841 -0.618 . . . . 0.38 109.869 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 39' ' ' ILE . 54.1 t -55.79 -53.66 35.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.804 -0.635 . . . . 0.34 110.958 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.5 m -55.3 -53.09 60.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.998 -0.546 . . . . 0.41 111.48 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.54 ' CE ' ' CD1' ' A' ' 20' ' ' ILE . 7.9 mtmm -65.22 -43.42 91.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.467 -0.333 . . . . 1.36 111.327 -179.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.53 -46.49 73.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.903 0.383 . . . . 0.35 110.163 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 1.013 ' CD2' ' SD ' ' A' ' 98' ' ' MET . 42.6 t80 -66.27 -58.97 4.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.964 -0.562 . . . . 0.7 110.063 179.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.419 ' C ' ' H ' ' A' ' 50' ' ' ASP . 53.1 t80 -55.42 -46.72 76.65 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.356 -0.838 . . . . 2.02 111.321 -179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -74.17 16.48 0.24 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.48 -0.327 . . . . 0.47 111.165 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 48' ' ' PHE . 57.8 t0 44.04 40.25 3.28 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.787 0.327 . . . . 1.35 110.555 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.6 mm -80.7 133.41 29.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.53 110.577 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.759 ' OG ' HD23 ' C' ' 431' ' ' LEU . 7.8 m -89.93 151.96 21.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.151 -0.477 . . . . 0.42 110.318 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.741 HG12 ' CG ' ' A' ' 57' ' ' LEU . 20.0 t -55.11 -23.4 13.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.191 -0.458 . . . . 0.28 110.432 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.907 ' OG ' ' HB2' ' C' ' 429' ' ' GLN . 0.3 OUTLIER -46.29 -62.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.191 -0.459 . . . . 1.24 110.587 179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.903 ' OE1' HD22 ' A' ' 14' ' ' LEU . 54.6 mt-30 -56.73 -42.38 79.15 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.857 -0.337 . . . . 1.24 110.393 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.41 HG23 ' H ' ' A' ' 56' ' ' VAL . 4.1 t -58.47 -41.37 81.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 N-CA-C 108.913 -0.773 . . . . 0.24 108.913 178.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 1.08 ' HB3' ' HB1' ' C' ' 422' ' ' ALA . 2.2 mt -73.07 -46.85 49.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.274 -0.875 . . . . 0.25 110.343 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.818 ' OE2' ' HB2' ' C' ' 425' ' ' ALA . 18.7 mt-10 -70.05 -50.53 40.28 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.055 -0.52 . . . . 1.13 111.216 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.474 HG13 ' O ' ' A' ' 55' ' ' GLN . 56.2 mt -54.57 -38.07 40.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 C-N-CA 120.616 -0.434 . . . . 0.26 109.931 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.725 ' CE1' ' HB2' ' A' ' 88' ' ' LEU . 43.9 t60 -59.21 -51.16 71.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.99 111.007 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.569 HG23 ' O ' ' A' ' 57' ' ' LEU . 28.7 t -52.97 -51.64 36.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.193 -0.458 . . . . 0.29 111.625 -179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.809 ' HA ' ' OE1' ' A' ' 62' ' ' GLU . 0.6 OUTLIER -53.89 -52.57 60.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.578 -0.283 . . . . 1.71 111.582 -178.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.115 ' CD1' HD13 ' D' ' 506' ' ' ILE . 24.4 tp -61.31 -40.77 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.465 -0.494 . . . . 0.41 110.064 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' MET . . . . . 1.059 ' SD ' ' CD2' ' A' ' 84' ' ' TYR . 2.3 mmt -57.42 -41.08 79.68 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.539 -0.541 . . . . 1.14 109.539 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -62.75 -28.77 70.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.898 -0.592 . . . . 1.3 109.436 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.972 HG21 HD12 ' D' ' 506' ' ' ILE . 5.5 m -66.83 -41.06 88.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.478 -0.783 . . . . 0.43 110.751 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 1.137 ' CE1' HG22 ' D' ' 506' ' ' ILE . 54.2 m-85 -73.44 -46.52 47.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.267 -0.424 . . . . 0.77 110.894 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 5.0 p -57.8 -41.16 81.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.032 0.444 . . . . 1.43 110.234 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -59.84 -50.75 72.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.743 -0.662 . . . . 2.18 110.663 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 66' ' ' THR . 75.2 mt-30 -60.1 -45.02 94.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 2.08 110.637 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.58 HD23 ' HA ' ' A' ' 78' ' ' GLU . 0.2 OUTLIER -51.56 -38.62 55.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.42 -0.355 . . . . 0.64 110.714 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.975 ' HE3' ' OE1' ' C' ' 417' ' ' GLU . 68.4 mttt -71.17 -53.09 15.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.319 -0.4 . . . . 2.19 110.663 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 80.5 mt -63.76 -32.29 73.74 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.189 -0.46 . . . . 0.91 110.913 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.426 ' OE1' ' HD2' ' A' ' 76' ' ' ARG . 95.8 mt-10 -97.81 -4.2 37.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.372 -0.376 . . . . 1.41 110.812 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.44 ' N ' ' O ' ' A' ' 71' ' ' LEU . . . 51.51 57.89 11.13 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.402 -1.079 . . . . 0.75 110.402 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.612 ' HB3' ' OG1' ' D' ' 511' ' ' THR . 1.9 mtt180 -118.29 142.75 47.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.707 0.289 . . . . 1.96 111.226 -179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.418 ' O ' HG22 ' A' ' 80' ' ' ILE . 7.7 t -41.59 113.49 0.42 Allowed 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 109.726 -0.472 . . . . 1.42 109.726 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.954 ' OE1' ' OE2' ' C' ' 417' ' ' GLU . 12.1 pt-20 -79.63 -6.3 56.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.346 -0.388 . . . . 1.39 110.633 -179.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.846 ' HB3' ' CG2' ' D' ' 515' ' ' VAL . 70.2 m-20 -53.93 -34.38 59.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.107 -0.497 . . . . 1.78 110.571 179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.666 HD13 ' HA ' ' D' ' 510' ' ' PRO . 0.8 OUTLIER -52.32 -15.06 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 0.69 110.781 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 78' ' ' GLU . 2.0 mp -59.27 -20.19 52.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.226 -0.443 . . . . 0.89 111.027 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 1.011 ' CD1' ' OG1' ' D' ' 519' ' ' THR . 0.4 OUTLIER -60.55 -28.7 68.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.884 0.373 . . . . 1.16 110.839 -179.721 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ASP . . . . . 0.876 ' OD1' ' N ' ' A' ' 84' ' ' TYR . 45.4 p-10 -59.22 -45.96 89.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.071 -0.513 . . . . 1.23 110.424 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 1.059 ' CD2' ' SD ' ' A' ' 64' ' ' MET . 8.2 m-85 -58.78 -39.23 80.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.58 110.174 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 1.43 ' NH2' ' NH2' ' B' ' 285' ' ' ARG . 0.0 OUTLIER -66.28 -41.83 89.29 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.287 -0.634 . . . . 3.04 109.287 179.364 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.865 HD21 ' CA ' ' D' ' 521' ' ' LEU . 66.0 mt -69.01 -33.67 74.03 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 121.347 0.594 . . . . 0.67 109.523 178.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' THR . . . . . 0.819 ' O ' HG23 ' A' ' 91' ' ' VAL . 25.8 m -77.77 -40.27 41.38 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.336 -0.847 . . . . 0.33 110.208 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.734 HD13 ' C ' ' A' ' 88' ' ' LEU . 2.9 tm? -67.54 -49.1 64.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.778 -0.646 . . . . 0.3 110.753 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.408 HD12 ' CD2' ' D' ' 521' ' ' LEU . 97.9 mt -68.11 -42.9 85.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.16 -0.473 . . . . 0.23 110.376 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ASP . . . . . 0.803 ' OD1' ' NZ ' ' D' ' 526' ' ' LYS . 47.2 t0 -64.28 -45.7 86.91 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 1.79 110.547 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 87' ' ' THR . 53.3 t -58.9 -54.03 39.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.23 110.497 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.698 ' O ' HD23 ' A' ' 95' ' ' LEU . 72.9 mt -57.68 -43.12 83.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.131 -0.486 . . . . 0.3 110.653 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.38 -32.3 73.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.988 -0.551 . . . . 0.21 111.271 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' HIS . . . . . 0.735 ' ND1' HG21 ' A' ' 43' ' ' VAL . 10.9 t-160 -70.71 -51.25 28.72 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.938 -0.305 . . . . 1.3 111.483 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LEU . . . . . 0.698 HD23 ' O ' ' A' ' 92' ' ' ILE . 0.2 OUTLIER -71.23 -35.52 71.51 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.385 -0.526 . . . . 0.83 110.095 -179.707 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' CYS . . . . . 0.608 ' N ' ' HG ' ' A' ' 95' ' ' LEU . 28.6 t -60.2 -34.56 73.8 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.056 -0.72 . . . . 1.08 109.056 178.939 -169.895 147.172 -112.658 104.35 2.021 104.298 -71.517 -80.84 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.981 ' OE1' ' HA ' ' A' ' 97' ' ' GLU . 0.0 OUTLIER -66.85 -40.73 88.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.68 -0.691 . . . . 1.9 109.517 178.898 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . 1.013 ' SD ' ' CD2' ' A' ' 47' ' ' PHE . 0.0 OUTLIER -59.28 -41.57 89.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.898 -0.592 . . . . 1.28 110.084 179.366 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.934 ' N ' ' HG3' ' A' ' 98' ' ' MET . 19.9 m-85 -56.27 -48.79 75.89 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.023 -0.535 . . . . 0.74 110.346 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.964 HH22 ' CD2' ' D' ' 531' ' ' LEU . 29.8 ttp180 -57.35 -36.49 71.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.862 -0.608 . . . . 2.58 110.993 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.466 HH11 ' HD3' ' A' ' 101' ' ' ARG . 56.6 mtt180 -75.02 -29.52 60.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.225 -0.443 . . . . 2.2 110.725 -179.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.39 7.94 3.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 1.35 110.472 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 100' ' ' ARG . 0.2 OUTLIER -106.93 99.07 23.95 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.138 -0.483 . . . . 0.71 110.831 -179.461 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -68.79 115.49 3.98 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 C-N-CA 122.461 2.107 . . . . 1.28 110.733 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ARG . . . . . 0.636 ' C ' ' OE1' ' A' ' 106' ' ' GLU . 6.6 mmm-85 -119.35 144.28 46.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.329 -0.396 . . . . 3.86 111.522 -178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLU . . . . . 1.279 ' O ' HG12 ' A' ' 107' ' ' VAL . 0.0 OUTLIER -65.77 173.3 2.93 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.269 -0.423 . . . . 3.38 109.86 179.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' VAL . . . . . 1.279 HG12 ' O ' ' A' ' 106' ' ' GLU . 4.0 p . . . . . 0 C--O 1.221 -0.445 0 CA-C-O 117.932 -1.032 . . . . 5.44 110.633 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' ALA . . . . . 0.495 ' O ' ' C ' ' B' ' 202' ' ' MET . . . . . . . . 0 N--CA 1.487 1.383 0 N-CA-C 108.99 -0.745 . . . . 7.67 108.99 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' MET . . . . . 1.148 ' O ' ' HE2' ' B' ' 202' ' ' MET . 0.0 OUTLIER -37.35 148.3 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.738 -0.838 . . . . 5.47 108.738 178.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' ALA . . . . . 0.843 ' O ' ' HG2' ' B' ' 204' ' ' ARG . . . -42.49 86.4 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 118.357 -1.337 . . . . 4.42 108.243 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' ARG . . . . . 1.031 ' HG3' HH11 ' B' ' 204' ' ' ARG . 0.0 OUTLIER 54.07 20.46 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.639 -0.709 . . . . 8.03 111.426 -179.097 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' MET . . . . . 1.129 ' N ' ' HE2' ' B' ' 202' ' ' MET . 19.4 mtt -81.68 88.98 6.22 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 120.611 -0.435 . . . . 5.09 110.208 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.76 168.27 20.53 Favored Pre-proline 0 C--N 1.331 -0.198 0 N-CA-C 109.539 -0.541 . . . . 2.2 109.539 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -67.82 -13.08 37.51 Favored 'Trans proline' 0 C--N 1.303 -1.831 0 C-N-CA 122.193 1.928 . . . . 1.45 111.765 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' ALA . . . . . . . . . . . . . . . -72.57 -55.62 6.63 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.999 -0.546 . . . . 0.95 110.133 179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' ASP . . . . . 0.419 ' O ' ' HB3' ' B' ' 212' ' ' LYS . 88.0 m-20 -46.07 -45.89 16.51 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.798 -0.445 . . . . 1.42 109.798 179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 210' ' ' LYS . . . . . 1.003 ' HE3' ' OE1' ' D' ' 532' ' ' GLU . 0.1 OUTLIER -59.34 -46.11 89.52 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.446 -0.575 . . . . 1.83 109.446 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 211' ' ' ARG . . . . . 0.638 ' O ' ' HD2' ' B' ' 211' ' ' ARG . 5.0 tpt180 -62.18 -38.49 89.27 Favored 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 108.989 -0.745 . . . . 1.97 108.989 178.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 212' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' B' ' 209' ' ' ASP . 0.3 OUTLIER -58.65 -44.65 90.16 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 108.105 -1.072 . . . . 2.01 108.105 178.375 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 213' ' ' LEU . . . . . 0.87 ' O ' ' HG ' ' B' ' 217' ' ' LEU . 0.2 OUTLIER -58.05 -49.26 77.49 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 108.452 -0.944 . . . . 0.46 108.452 177.794 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 214' ' ' LEU . . . . . 0.902 HD22 ' OE1' ' B' ' 255' ' ' GLN . 47.7 mt -56.66 -44.57 81.47 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.314 -0.857 . . . . 0.56 109.199 178.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 215' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -58.57 -38.99 79.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.299 -0.864 . . . . 1.16 109.962 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 216' ' ' GLU . . . . . 0.646 ' O ' HG13 ' B' ' 220' ' ' ILE . 56.4 mt-10 -79.11 -43.96 23.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.687 -0.688 . . . . 1.8 110.161 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 217' ' ' LEU . . . . . 0.87 ' HG ' ' O ' ' B' ' 213' ' ' LEU . 48.9 mt -59.36 -35.82 74.59 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 108.984 -0.747 . . . . 0.54 108.984 178.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 218' ' ' ARG . . . . . 0.502 ' HB2' ' O ' ' B' ' 214' ' ' LEU . 18.0 ttt180 -61.7 -53.83 50.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.076 -0.966 . . . . 3.05 109.648 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 219' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.96 -43.26 79.43 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.829 -0.623 . . . . 1.15 110.082 179.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 220' ' ' ILE . . . . . 0.646 HG13 ' O ' ' B' ' 216' ' ' GLU . 92.9 mt -57.79 -51.47 69.96 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 N-CA-C 109.552 -0.536 . . . . 0.35 109.552 179.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 221' ' ' TYR . . . . . 0.786 ' HA ' HD12 ' B' ' 224' ' ' ILE . 67.9 t80 -53.32 -51.33 62.71 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 108.356 -0.979 . . . . 0.4 108.356 178.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 222' ' ' ARG . . . . . 0.466 ' HD2' HG12 ' C' ' 406' ' ' ILE . 22.4 ttp180 -52.8 -50.25 64.0 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.489 -1.232 . . . . 2.16 110.356 179.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 223' ' ' THR . . . . . 0.442 ' CG2' ' HD2' ' B' ' 238' ' ' ARG . 81.4 m -55.91 -41.36 74.41 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.008 -0.542 . . . . 0.23 110.443 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 224' ' ' ILE . . . . . 0.786 HD12 ' HA ' ' B' ' 221' ' ' TYR . 84.1 mt -55.5 -40.14 57.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.459 . . . . 0.3 110.169 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 225' ' ' VAL . . . . . 0.506 HG11 ' CE1' ' B' ' 284' ' ' TYR . 77.6 t -66.63 -49.89 70.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.809 -0.632 . . . . 0.35 111.118 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 226' ' ' LEU . . . . . 0.625 HD23 ' HA2' ' C' ' 408' ' ' GLY . 50.9 mt -58.42 -38.64 77.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.277 -0.42 . . . . 0.55 111.352 -179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 227' ' ' GLU . . . . . 0.667 ' CD ' ' HE ' ' B' ' 238' ' ' ARG . 93.8 mt-10 -88.06 -7.01 57.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.426 -0.352 . . . . 1.05 111.594 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -51.38 -32.43 26.0 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.452 -0.499 . . . . 0.55 110.143 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 229' ' ' PHE . . . . . 1.081 ' HB3' ' NH1' ' C' ' 412' ' ' ARG . 39.4 m-85 -107.41 17.28 22.98 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.63 110.664 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 230' ' ' ASN . . . . . 0.984 ' CB ' ' HB3' ' B' ' 233' ' ' ALA . 2.3 p-10 -59.74 149.91 29.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.76 110.63 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 231' ' ' THR . . . . . . . . . . . . . 35.0 p -90.98 -24.97 19.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.79 110.793 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 232' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -138.09 -12.53 1.44 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.394 -0.367 . . . . 1.51 110.983 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 233' ' ' ALA . . . . . 0.984 ' HB3' ' CB ' ' B' ' 230' ' ' ASN . . . -65.7 126.72 29.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.841 0.353 . . . . 1.18 110.836 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 234' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' B' ' 236' ' ' ASN . 11.7 mttt -81.77 71.16 8.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 1.93 110.102 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 235' ' ' VAL . . . . . 0.623 ' CG2' ' OD1' ' B' ' 230' ' ' ASN . 2.2 t -39.5 -30.9 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.105 -0.498 . . . . 0.36 110.141 -179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 236' ' ' ASN . . . . . 0.501 ' OD1' ' C ' ' B' ' 236' ' ' ASN . 15.0 t-20 -50.56 -38.81 47.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.012 -0.54 . . . . 1.23 109.896 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 237' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -62.36 -36.59 82.7 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.477 -0.564 . . . . 1.49 109.477 179.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 238' ' ' ARG . . . . . 0.667 ' HE ' ' CD ' ' B' ' 227' ' ' GLU . 22.8 mmt180 -71.55 -47.16 56.88 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.719 -0.673 . . . . 1.72 109.333 178.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 239' ' ' ILE . . . . . 0.763 ' O ' HG23 ' B' ' 243' ' ' VAL . 25.3 mt -67.05 -36.7 77.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.369 -0.832 . . . . 0.33 110.045 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 240' ' ' ASP . . . . . 0.433 ' N ' ' O ' ' B' ' 236' ' ' ASN . 62.7 t0 -69.0 -39.96 79.03 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.973 -0.558 . . . . 1.19 109.713 179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 241' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -65.14 -49.44 69.85 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.963 -0.562 . . . . 1.43 109.86 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 242' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -63.26 -48.52 77.86 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.809 -0.632 . . . . 0.38 109.854 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 243' ' ' VAL . . . . . 0.763 HG23 ' O ' ' B' ' 239' ' ' ILE . 54.6 t -55.75 -53.77 33.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.863 -0.608 . . . . 0.34 110.954 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 244' ' ' SER . . . . . . . . . . . . . 71.0 m -55.25 -53.06 60.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.966 -0.561 . . . . 0.41 111.488 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 245' ' ' LYS . . . . . 0.528 ' CE ' ' CD1' ' B' ' 220' ' ' ILE . 7.9 mtmm -65.23 -43.4 91.57 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.48 -0.327 . . . . 1.35 111.333 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 246' ' ' ALA . . . . . . . . . . . . . . . -54.51 -46.53 73.5 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.945 0.402 . . . . 0.35 110.176 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 247' ' ' PHE . . . . . 1.005 ' CD2' ' SD ' ' B' ' 298' ' ' MET . 42.6 t80 -66.28 -58.95 4.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.933 -0.576 . . . . 0.7 110.08 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 248' ' ' PHE . . . . . 0.432 ' C ' ' H ' ' B' ' 250' ' ' ASP . 53.1 t80 -55.38 -46.7 76.52 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.284 -0.871 . . . . 2.02 111.386 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 249' ' ' ALA . . . . . . . . . . . . . . . -74.25 16.56 0.24 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.442 -0.345 . . . . 0.47 111.178 -179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 250' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' B' ' 248' ' ' PHE . 57.9 t0 44.02 40.29 3.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.82 0.343 . . . . 1.35 110.513 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 251' ' ' ILE . . . . . . . . . . . . . 2.6 mm -80.76 133.47 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.231 -0.441 . . . . 0.52 110.554 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 252' ' ' SER . . . . . 0.762 ' OG ' HD23 ' D' ' 531' ' ' LEU . 7.8 m -89.92 151.95 21.47 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.12 -0.491 . . . . 0.42 110.33 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 253' ' ' VAL . . . . . 0.749 HG12 ' CG ' ' B' ' 257' ' ' LEU . 19.9 t -55.19 -23.3 13.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.28 110.463 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 254' ' ' SER . . . . . 0.899 ' OG ' ' HB2' ' D' ' 529' ' ' GLN . 0.3 OUTLIER -46.25 -62.64 1.26 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.19 -0.459 . . . . 1.24 110.612 179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 255' ' ' GLN . . . . . 0.902 ' OE1' HD22 ' B' ' 214' ' ' LEU . 54.6 mt-30 -56.72 -42.38 79.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.477 -0.328 . . . . 1.23 110.424 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 256' ' ' VAL . . . . . . . . . . . . . 4.1 t -58.5 -41.35 81.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 108.859 -0.793 . . . . 0.24 108.859 178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 257' ' ' LEU . . . . . 1.04 ' HB3' ' HB1' ' D' ' 522' ' ' ALA . 2.1 mt -73.09 -46.86 49.06 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.294 -0.866 . . . . 0.26 110.371 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 258' ' ' GLU . . . . . 0.806 ' OE2' ' HB2' ' D' ' 525' ' ' ALA . 18.7 mt-10 -70.03 -50.49 40.83 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.012 -0.54 . . . . 1.14 111.23 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 259' ' ' ILE . . . . . 0.496 ' N ' ' O ' ' B' ' 255' ' ' GLN . 56.0 mt -54.62 -38.07 41.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.634 -0.426 . . . . 0.26 109.889 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 260' ' ' HIS . . . . . 0.734 ' CE1' ' HB2' ' B' ' 288' ' ' LEU . 43.8 t60 -59.24 -51.11 71.38 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.988 -0.551 . . . . 0.99 111.038 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 261' ' ' VAL . . . . . 0.575 HG23 ' O ' ' B' ' 257' ' ' LEU . 28.5 t -52.9 -51.74 34.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.229 -0.441 . . . . 0.29 111.664 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 262' ' ' GLU . . . . . 0.847 ' HA ' ' OE1' ' B' ' 262' ' ' GLU . 0.6 OUTLIER -53.88 -52.54 60.15 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.561 -0.29 . . . . 1.71 111.546 -178.784 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 263' ' ' LEU . . . . . 1.121 ' CD1' HD13 ' C' ' 406' ' ' ILE . 24.5 tp -61.33 -40.76 95.41 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.474 -0.491 . . . . 0.41 110.081 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 264' ' ' MET . . . . . 1.073 ' SD ' ' CD2' ' B' ' 284' ' ' TYR . 2.3 mmt -57.38 -41.11 79.58 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.55 -0.537 . . . . 1.14 109.55 179.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 265' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -62.8 -28.71 70.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.869 -0.605 . . . . 1.3 109.478 178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 266' ' ' THR . . . . . 1.023 HG21 HD12 ' C' ' 406' ' ' ILE . 5.4 m -66.8 -41.08 88.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.484 -0.78 . . . . 0.42 110.802 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 267' ' ' PHE . . . . . 1.125 ' CE1' HG22 ' C' ' 406' ' ' ILE . 54.2 m-85 -73.4 -46.58 47.94 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.246 -0.434 . . . . 0.77 110.895 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 268' ' ' SER . . . . . . . . . . . . . 5.0 p -57.77 -41.23 81.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.007 0.432 . . . . 1.43 110.189 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 269' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -59.84 -50.69 72.82 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.781 -0.645 . . . . 2.18 110.722 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 270' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' B' ' 266' ' ' THR . 75.1 mt-30 -60.06 -45.07 94.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 2.09 110.68 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 271' ' ' LEU . . . . . 0.595 HD23 ' HA ' ' B' ' 278' ' ' GLU . 0.2 OUTLIER -51.51 -38.7 55.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 0.64 110.691 179.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 272' ' ' LYS . . . . . 0.997 ' HE3' ' OE1' ' D' ' 517' ' ' GLU . 68.3 mttt -71.1 -53.04 15.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.363 -0.38 . . . . 2.19 110.702 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . 80.6 mt -63.79 -32.3 73.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.23 -0.441 . . . . 0.91 110.926 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 274' ' ' GLU . . . . . 0.426 ' OE1' ' HD2' ' B' ' 276' ' ' ARG . 95.8 mt-10 -97.88 -4.16 37.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.277 -0.42 . . . . 1.41 110.724 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 275' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' B' ' 271' ' ' LEU . . . 51.46 57.95 10.92 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.412 -1.075 . . . . 0.76 110.412 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 276' ' ' ARG . . . . . 0.623 ' HB3' ' OG1' ' C' ' 411' ' ' THR . 1.9 mtt180 -118.33 142.72 47.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.647 0.26 . . . . 1.96 111.234 -179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 277' ' ' SER . . . . . 0.42 ' O ' HG22 ' B' ' 280' ' ' ILE . 7.7 t -41.52 113.48 0.41 Allowed 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.697 -0.483 . . . . 1.42 109.697 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 278' ' ' GLU . . . . . 0.943 ' OE1' ' OE2' ' D' ' 517' ' ' GLU . 12.0 pt-20 -79.61 -6.39 56.98 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.849 0.356 . . . . 1.39 110.583 -179.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 279' ' ' ASP . . . . . 0.861 ' HB3' ' CG2' ' C' ' 415' ' ' VAL . 70.3 m-20 -53.94 -34.33 59.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 1.77 110.598 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 280' ' ' ILE . . . . . 0.677 HD13 ' HA ' ' C' ' 410' ' ' PRO . 0.8 OUTLIER -52.32 -15.11 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.69 110.758 -179.992 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 281' ' ' LEU . . . . . 0.549 ' HB2' ' O ' ' B' ' 278' ' ' GLU . 2.0 mp -59.15 -20.22 51.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.257 -0.428 . . . . 0.88 111.112 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 282' ' ' LEU . . . . . 0.986 ' CD1' ' OG1' ' C' ' 419' ' ' THR . 0.4 OUTLIER -60.53 -28.7 68.62 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.863 0.363 . . . . 1.17 110.834 -179.753 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 283' ' ' ASP . . . . . 0.886 ' OD1' ' N ' ' B' ' 284' ' ' TYR . 45.3 p-10 -59.25 -45.9 89.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.084 -0.507 . . . . 1.23 110.479 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 284' ' ' TYR . . . . . 1.073 ' CD2' ' SD ' ' B' ' 264' ' ' MET . 8.2 m-85 -58.82 -39.18 80.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 0.58 110.179 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 285' ' ' ARG . . . . . 1.43 ' NH2' ' NH2' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -66.3 -41.83 89.2 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.316 -0.624 . . . . 3.03 109.316 179.34 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 286' ' ' LEU . . . . . 0.848 HD21 ' CA ' ' C' ' 421' ' ' LEU . 65.7 mt -69.08 -33.54 73.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 121.408 0.623 . . . . 0.67 109.527 178.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 287' ' ' THR . . . . . 0.815 ' O ' HG23 ' B' ' 291' ' ' VAL . 26.1 m -77.85 -40.28 40.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.323 -0.853 . . . . 0.33 110.169 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 288' ' ' LEU . . . . . 0.738 ' C ' HD13 ' B' ' 288' ' ' LEU . 2.9 tm? -67.59 -49.06 64.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.797 -0.638 . . . . 0.3 110.794 179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 289' ' ' ILE . . . . . . . . . . . . . 98.0 mt -68.13 -42.86 85.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 0.23 110.444 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 290' ' ' ASP . . . . . 0.809 ' OD1' ' NZ ' ' C' ' 426' ' ' LYS . 47.4 t0 -64.25 -45.72 86.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.148 -0.478 . . . . 1.79 110.575 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 291' ' ' VAL . . . . . 0.815 HG23 ' O ' ' B' ' 287' ' ' THR . 53.2 t -58.87 -54.07 38.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.23 110.51 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 292' ' ' ILE . . . . . 0.694 ' O ' HD23 ' B' ' 295' ' ' LEU . 73.1 mt -57.71 -43.11 83.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.139 -0.482 . . . . 0.3 110.658 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 293' ' ' ALA . . . . . . . . . . . . . . . -64.4 -32.17 73.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.044 -0.526 . . . . 0.21 111.278 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 294' ' ' HIS . . . . . 0.734 ' ND1' HG21 ' B' ' 243' ' ' VAL . 11.0 t-160 -70.81 -51.29 27.68 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.927 -0.309 . . . . 1.3 111.459 -179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 295' ' ' LEU . . . . . 0.694 HD23 ' O ' ' B' ' 292' ' ' ILE . 0.2 OUTLIER -71.12 -35.56 71.81 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.442 -0.503 . . . . 0.83 109.996 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 296' ' ' CYS . . . . . 0.61 ' N ' ' HG ' ' B' ' 295' ' ' LEU . 19.3 m -59.38 -35.3 73.67 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.098 -0.704 . . . . 0.66 109.098 178.827 -80.84 -71.517 -112.658 104.298 2.021 104.35 147.172 -169.895 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 297' ' ' GLU . . . . . 0.991 ' OE1' ' HA ' ' B' ' 297' ' ' GLU . 0.0 OUTLIER -67.13 -40.64 86.83 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.524 -0.762 . . . . 1.9 109.682 179.115 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 298' ' ' MET . . . . . 1.005 ' SD ' ' CD2' ' B' ' 247' ' ' PHE . 0.0 OUTLIER -59.36 -41.56 89.56 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.872 -0.604 . . . . 1.28 110.017 179.391 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 299' ' ' TYR . . . . . 0.968 ' N ' ' HG3' ' B' ' 298' ' ' MET . 20.3 m-85 -56.22 -48.79 75.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.095 -0.502 . . . . 0.74 110.371 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 300' ' ' ARG . . . . . 0.948 HH22 ' CD2' ' C' ' 431' ' ' LEU . 29.7 ttp180 -57.34 -36.52 71.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.836 -0.62 . . . . 2.59 111.007 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 301' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' B' ' 301' ' ' ARG . 56.6 mtt180 -74.96 -29.6 60.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.213 -0.449 . . . . 2.21 110.75 -179.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 302' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.28 7.94 3.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.247 -0.433 . . . . 1.35 110.449 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 303' ' ' ILE . . . . . 0.528 HG13 ' O ' ' B' ' 300' ' ' ARG . 0.2 OUTLIER -106.99 98.95 23.54 Favored Pre-proline 0 C--N 1.326 -0.42 0 CA-C-N 116.188 -0.46 . . . . 0.72 110.801 -179.364 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 304' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -68.62 115.43 3.91 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 C-N-CA 122.544 2.162 . . . . 1.28 110.743 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 305' ' ' ARG . . . . . 0.649 ' C ' ' OE1' ' B' ' 306' ' ' GLU . 6.6 mmm-85 -119.36 144.27 46.97 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.379 -0.373 . . . . 3.86 111.505 -178.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 306' ' ' GLU . . . . . 1.27 ' O ' HG12 ' B' ' 307' ' ' VAL . 0.0 OUTLIER -65.79 173.27 2.97 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.835 -0.431 . . . . 3.38 109.835 179.397 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 307' ' ' VAL . . . . . 1.27 HG12 ' O ' ' B' ' 306' ' ' GLU . 3.9 p . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.965 -1.017 . . . . 5.45 110.575 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 401' ' ' ALA . . . . . 0.98 ' O ' ' CG ' ' C' ' 402' ' ' MET . . . . . . . . 0 N--CA 1.501 2.11 0 N-CA-C 108.937 -0.764 . . . . 7.88 108.937 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 402' ' ' MET . . . . . 0.98 ' CG ' ' O ' ' C' ' 401' ' ' ALA . 0.0 OUTLIER 135.29 -44.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.666 -1.152 . . . . 8.69 109.729 179.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 403' ' ' ALA . . . . . 0.787 ' CB ' ' O ' ' C' ' 402' ' ' MET . . . 115.86 -64.61 0.0 OUTLIER 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 120.817 0.341 . . . . 5.2 111.781 178.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 404' ' ' GLY . . . . . . . . . . . . . . . -57.37 74.33 0.01 OUTLIER Glycine 0 CA--C 1.526 0.723 0 CA-C-N 115.741 -0.663 . . . . 3.08 113.05 -178.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 405' ' ' ILE . . . . . 0.749 HG22 ' O ' ' C' ' 405' ' ' ILE . 0.7 OUTLIER -80.01 95.53 2.31 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.229 -0.656 . . . . 2.91 109.229 178.08 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 406' ' ' ILE . . . . . 1.125 HG22 ' CE1' ' B' ' 267' ' ' PHE . 32.1 mt -59.03 123.43 11.26 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.17 0 CA-C-N 115.673 -0.694 . . . . 2.52 111.493 -178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 407' ' ' SER . . . . . 0.481 ' O ' ' HE1' ' B' ' 267' ' ' PHE . 5.5 t -109.15 -80.65 0.58 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.442 -0.799 . . . . 2.47 109.098 179.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 408' ' ' GLY . . . . . 1.297 ' O ' ' CG2' ' C' ' 409' ' ' THR . . . 97.94 -45.1 1.73 Allowed Glycine 0 CA--C 1.522 0.521 0 C-N-CA 121.198 -0.525 . . . . 2.36 112.042 178.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 409' ' ' THR . . . . . 1.297 ' CG2' ' O ' ' C' ' 408' ' ' GLY . 2.3 p 108.69 32.54 0.0 OUTLIER Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.244 0.545 . . . . 1.14 109.952 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 410' ' ' PRO . . . . . 0.87 ' CD ' ' H ' ' C' ' 409' ' ' THR . 92.6 Cg_exo -37.81 150.61 0.05 OUTLIER 'Trans proline' 0 C--N 1.298 -2.095 0 C-N-CA 123.344 2.696 . . . . 0.57 112.043 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 411' ' ' THR . . . . . 0.623 ' OG1' ' HB3' ' B' ' 276' ' ' ARG . 0.2 OUTLIER 56.55 60.32 3.16 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.765 -0.374 . . . . 1.61 110.572 179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 412' ' ' ARG . . . . . 1.081 ' NH1' ' HB3' ' B' ' 229' ' ' PHE . 0.0 OUTLIER -133.15 -44.49 0.85 Allowed 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.558 -0.457 . . . . 2.68 111.339 -179.45 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 413' ' ' ILE . . . . . 0.856 ' N ' ' HG3' ' C' ' 412' ' ' ARG . 1.5 tp -100.87 138.63 24.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.95 0.405 . . . . 1.1 111.413 -179.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 414' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.52 104.01 16.61 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.915 -0.584 . . . . 1.94 109.722 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 415' ' ' VAL . . . . . 0.87 ' CG1' HD13 ' B' ' 282' ' ' LEU . 22.7 m -109.07 147.83 13.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.053 -0.521 . . . . 1.24 111.928 -178.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 416' ' ' ASP . . . . . 0.77 ' O ' ' HB ' ' C' ' 419' ' ' THR . 19.2 t0 -106.9 -175.55 2.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.822 -0.626 . . . . 2.56 109.907 178.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 417' ' ' GLU . . . . . 0.975 ' OE1' ' HE3' ' A' ' 72' ' ' LYS . 1.4 mt-10 -35.03 -102.31 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.544 -0.298 . . . . 2.06 110.796 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 418' ' ' LYS . . . . . 0.899 ' O ' ' O ' ' C' ' 419' ' ' THR . 2.4 tttt -49.41 2.99 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.878 0.37 . . . . 1.97 110.589 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 419' ' ' THR . . . . . 1.112 ' O ' ' O ' ' C' ' 420' ' ' GLU . 3.1 t 5.47 126.38 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.097 -0.502 . . . . 1.42 110.761 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 420' ' ' GLU . . . . . 1.112 ' O ' ' O ' ' C' ' 419' ' ' THR . 5.3 mp0 -5.92 155.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.884 -0.598 . . . . 2.31 111.374 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 421' ' ' LEU . . . . . 0.848 ' CA ' HD21 ' B' ' 286' ' ' LEU . 0.3 OUTLIER -158.24 -128.68 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.974 -0.557 . . . . 1.47 110.783 179.974 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 422' ' ' ALA . . . . . 1.08 ' HB1' ' HB3' ' A' ' 57' ' ' LEU . . . -72.76 -0.62 13.77 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.912 0.387 . . . . 1.14 110.872 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 423' ' ' ARG . . . . . 0.868 ' HE ' ' HG3' ' C' ' 420' ' ' GLU . 0.0 OUTLIER -36.38 -23.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.042 -0.526 . . . . 2.22 111.437 -179.692 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 424' ' ' ILE . . . . . 1.304 ' O ' ' N ' ' C' ' 426' ' ' LYS . 36.5 pt -70.95 8.92 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.515 -0.311 . . . . 1.43 111.392 -178.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 425' ' ' ALA . . . . . 0.818 ' HB2' ' OE2' ' A' ' 58' ' ' GLU . . . 36.06 -45.28 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 120.276 -0.569 . . . . 0.79 109.619 -179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 426' ' ' LYS . . . . . 1.304 ' N ' ' O ' ' C' ' 424' ' ' ILE . 38.4 tptt 98.56 0.3 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.091 -0.504 . . . . 2.28 110.987 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 427' ' ' GLY . . . . . . . . . . . . . . . 71.09 16.15 74.83 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.357 -1.097 . . . . 1.37 110.357 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 428' ' ' MET . . . . . 0.653 ' CE ' ' HG2' ' C' ' 426' ' ' LYS . 8.4 mtt -89.34 -40.01 13.06 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 120.76 0.314 . . . . 2.1 110.894 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 429' ' ' GLN . . . . . 0.907 ' HB2' ' OG ' ' A' ' 54' ' ' SER . 35.6 tt0 -60.33 45.94 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.295 0.85 . . . . 2.09 113.295 -178.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 430' ' ' ASP . . . . . 0.554 ' N ' ' O ' ' C' ' 428' ' ' MET . 3.5 t0 -110.63 -11.76 14.4 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.769 -1.197 . . . . 2.17 107.769 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 431' ' ' LEU . . . . . 0.948 ' CD2' HH22 ' B' ' 300' ' ' ARG . 0.0 OUTLIER -50.87 77.8 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 112.891 -1.959 . . . . 2.7 115.958 -177.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 432' ' ' GLU . . . . . 0.976 ' OE1' ' HE3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER 151.28 -85.75 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 116.268 1.951 . . . . 4.47 116.268 175.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 433' ' ' SER . . . . . 0.598 ' HA ' ' OE1' ' C' ' 434' ' ' GLU . 0.5 OUTLIER -20.62 149.96 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 115.412 1.634 . . . . 5.69 115.412 -175.69 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 434' ' ' GLU . . . . . 1.111 ' N ' ' OE1' ' C' ' 434' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.348 0.521 0 CA-C-N 114.898 -1.046 . . . . 7.38 110.084 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 501' ' ' ALA . . . . . 0.985 ' O ' ' HG2' ' D' ' 502' ' ' MET . . . . . . . . 0 N--CA 1.502 2.139 0 N-CA-C 108.872 -0.788 . . . . 7.88 108.872 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 502' ' ' MET . . . . . 0.985 ' HG2' ' O ' ' D' ' 501' ' ' ALA . 0.0 OUTLIER 135.1 -44.05 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.58 -1.191 . . . . 8.69 109.934 179.594 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 503' ' ' ALA . . . . . 0.778 ' CB ' ' O ' ' D' ' 502' ' ' MET . . . 115.52 -64.54 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.801 0.334 . . . . 5.2 111.878 178.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 504' ' ' GLY . . . . . . . . . . . . . . . -57.44 74.19 0.01 OUTLIER Glycine 0 CA--C 1.526 0.764 0 CA-C-N 115.81 -0.632 . . . . 3.1 113.201 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 505' ' ' ILE . . . . . 0.742 HG22 ' O ' ' D' ' 505' ' ' ILE . 0.7 OUTLIER -79.84 95.33 2.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.363 -0.606 . . . . 2.92 109.363 178.134 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 506' ' ' ILE . . . . . 1.137 HG22 ' CE1' ' A' ' 67' ' ' PHE . 31.6 mt -58.81 123.42 10.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.757 -0.656 . . . . 2.5 111.463 -178.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 507' ' ' SER . . . . . 0.47 ' O ' ' HE1' ' A' ' 67' ' ' PHE . 5.5 t -109.2 -80.59 0.58 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.436 -0.802 . . . . 2.45 109.133 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 508' ' ' GLY . . . . . 1.311 ' O ' ' CG2' ' D' ' 509' ' ' THR . . . 97.84 -44.92 1.76 Allowed Glycine 0 CA--C 1.522 0.518 0 CA-C-N 116.055 -0.52 . . . . 2.36 112.026 178.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 509' ' ' THR . . . . . 1.311 ' CG2' ' O ' ' D' ' 508' ' ' GLY . 2.4 p 108.63 32.58 0.0 OUTLIER Pre-proline 0 C--N 1.322 -0.606 0 CA-C-O 121.279 0.562 . . . . 1.14 109.956 -179.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 510' ' ' PRO . . . . . 0.883 ' CD ' ' H ' ' D' ' 509' ' ' THR . 91.9 Cg_exo -37.85 150.6 0.05 OUTLIER 'Trans proline' 0 C--N 1.299 -2.05 0 C-N-CA 123.326 2.684 . . . . 0.57 112.078 -179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 511' ' ' THR . . . . . 0.612 ' OG1' ' HB3' ' A' ' 76' ' ' ARG . 0.2 OUTLIER 56.56 60.37 3.13 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.764 -0.375 . . . . 1.6 110.547 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 512' ' ' ARG . . . . . 1.116 ' NH1' ' HB3' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -133.18 -44.48 0.85 Allowed 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.559 -0.456 . . . . 2.68 111.363 -179.465 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 513' ' ' ILE . . . . . 0.858 ' N ' ' HG3' ' D' ' 512' ' ' ARG . 1.5 tp -100.91 138.63 24.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.969 0.414 . . . . 1.1 111.439 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 514' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -89.5 103.97 16.56 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.949 -0.569 . . . . 1.93 109.744 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 515' ' ' VAL . . . . . 0.855 ' CG1' HD13 ' A' ' 82' ' ' LEU . 22.8 m -109.05 147.84 13.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.049 -0.523 . . . . 1.23 111.902 -178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 516' ' ' ASP . . . . . 0.775 ' O ' ' HB ' ' D' ' 519' ' ' THR . 19.2 t0 -106.87 -175.6 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.785 -0.643 . . . . 2.56 109.905 178.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 517' ' ' GLU . . . . . 0.997 ' OE1' ' HE3' ' B' ' 272' ' ' LYS . 1.4 mt-10 -34.99 -102.3 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.541 -0.299 . . . . 2.07 110.785 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 518' ' ' LYS . . . . . 0.896 ' O ' ' O ' ' D' ' 519' ' ' THR . 2.3 tttt -49.45 3.01 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.86 0.362 . . . . 1.96 110.534 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 519' ' ' THR . . . . . 1.103 ' O ' ' O ' ' D' ' 520' ' ' GLU . 3.0 t 5.47 126.41 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.081 -0.508 . . . . 1.42 110.728 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 520' ' ' GLU . . . . . 1.103 ' O ' ' O ' ' D' ' 519' ' ' THR . 5.3 mp0 -5.97 155.93 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.877 -0.601 . . . . 2.32 111.35 179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 521' ' ' LEU . . . . . 0.865 ' CA ' HD21 ' A' ' 86' ' ' LEU . 0.3 OUTLIER -158.21 -128.67 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.968 -0.56 . . . . 1.47 110.785 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 522' ' ' ALA . . . . . 1.04 ' HB1' ' HB3' ' B' ' 257' ' ' LEU . . . -72.76 -0.62 13.77 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.3 -0.409 . . . . 1.15 110.879 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 523' ' ' ARG . . . . . 0.878 ' HE ' ' HG3' ' D' ' 520' ' ' GLU . 0.0 OUTLIER -36.37 -23.46 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.031 -0.531 . . . . 2.22 111.441 -179.709 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 524' ' ' ILE . . . . . 1.32 ' O ' ' N ' ' D' ' 526' ' ' LYS . 36.9 pt -71.05 9.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.575 -0.284 . . . . 1.43 111.353 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 525' ' ' ALA . . . . . 0.806 ' HB2' ' OE2' ' B' ' 258' ' ' GLU . . . 36.0 -45.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.253 -0.579 . . . . 0.79 109.636 -179.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 526' ' ' LYS . . . . . 1.32 ' N ' ' O ' ' D' ' 524' ' ' ILE . 38.4 tptt 98.59 0.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.134 -0.485 . . . . 2.28 110.967 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 527' ' ' GLY . . . . . . . . . . . . . . . 71.12 16.07 74.84 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 110.406 -1.078 . . . . 1.37 110.406 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' D' D ' 528' ' ' MET . . . . . 0.668 ' CE ' ' HG2' ' D' ' 526' ' ' LYS . 8.3 mtt -89.21 -40.08 13.1 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.766 0.317 . . . . 2.1 110.923 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 529' ' ' GLN . . . . . 0.899 ' HB2' ' OG ' ' B' ' 254' ' ' SER . 35.6 tt0 -60.28 45.8 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.314 0.857 . . . . 2.08 113.314 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 530' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' D' ' 528' ' ' MET . 3.5 t0 -110.45 -11.76 14.46 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 107.83 -1.174 . . . . 2.17 107.83 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' D' D ' 531' ' ' LEU . . . . . 0.964 ' CD2' HH22 ' A' ' 100' ' ' ARG . 0.0 OUTLIER -50.89 77.78 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 112.945 -1.934 . . . . 2.7 115.859 -177.429 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 532' ' ' GLU . . . . . 1.003 ' OE1' ' HE3' ' B' ' 210' ' ' LYS . 0.1 OUTLIER 151.29 -85.68 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 116.277 1.954 . . . . 4.47 116.277 175.748 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 533' ' ' SER . . . . . 0.611 ' HA ' ' OE1' ' D' ' 534' ' ' GLU . 0.5 OUTLIER -20.47 149.86 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 115.48 1.659 . . . . 5.69 115.48 -175.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' D' D ' 534' ' ' GLU . . . . . 1.11 ' OE1' ' N ' ' D' ' 534' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.348 0.53 0 CA-C-N 114.925 -1.034 . . . . 7.38 110.094 178.357 . . . . . . . . 2 2 . 1 stop_ save_