data_2lxy_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 2lxy _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.698 0.285 . . . . 0.0 111.627 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.01 -32.84 73.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.961 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -77.44 -19.96 55.25 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -50.14 19.09 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.8 t -74.83 -29.26 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -36.57 81.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -24.22 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.535 0.683 . . . . 0.0 109.547 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.426 HD23 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.94 -25.11 66.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.954 179.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.413 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.9 tt0 -77.67 -44.46 27.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.168 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -52.31 -27.28 14.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -53.19 8.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.225 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.3 t -64.8 -52.03 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.312 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 12.1 mttt -52.23 -25.65 9.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.448 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.61 -11.04 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.444 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.526 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -27.75 65.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.776 0.322 . . . . 0.0 111.034 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.1 mt -72.73 -29.53 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.442 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -56.17 12.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.804 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.61 -35.98 77.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 111.483 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 83.6 mt -71.1 -21.48 62.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.944 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -76.37 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 mttm -54.04 -43.04 69.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.352 . . . . 0.0 111.496 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.429 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -72.54 -25.11 61.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.695 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.85 -57.77 8.83 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.805 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.447 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.18 -49.15 62.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.447 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.9 pt-20 -54.32 -28.55 43.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 0.0 110.989 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.1 tp -67.72 -41.98 82.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.064 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -58.21 9.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.287 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptpm? -51.11 -28.02 9.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.318 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -70.91 -25.9 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.419 HD12 HG22 ' A' ' 41' ' ' ILE . 6.8 mt -77.84 -30.54 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.824 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -67.45 -41.03 85.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.588 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.405 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.9 pt-20 -66.84 -35.42 80.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.513 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 10.9 mt . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.113 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.703 0.287 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 18.3 t -55.37 -22.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.504 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -72.33 -36.08 68.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.097 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -64.83 -57.41 8.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.961 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.401 ' CG2' ' CD1' ' A' ' 44' ' ' LEU . 28.0 t -57.96 -26.28 28.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.27 -37.32 87.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 110.414 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -71.85 -28.18 63.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.577 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -68.78 -29.46 67.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.872 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.7 t -83.25 -25.55 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.026 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -73.83 -28.26 61.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.522 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -75.37 -44.0 47.34 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.426 ' CD2' HD23 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -74.02 -25.12 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.01 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.43 -55.3 9.36 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.055 0.455 . . . . 0.0 110.752 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -62.22 -26.81 68.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.214 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -56.74 14.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.413 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.402 HG23 HD13 ' A' ' 64' ' ' ILE . 21.5 mt -58.19 -24.57 24.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.345 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -31.76 58.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.515 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp . . . . . 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 111.364 -179.631 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.144 0 CA-C-O 120.739 0.304 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -61.51 -34.83 76.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.884 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.1 -19.57 56.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.722 0.296 . . . . 0.0 111.604 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.8 -44.51 63.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.671 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.1 -29.05 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.913 -179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -36.53 83.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.248 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.68 -26.66 34.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.545 0.688 . . . . 0.0 109.565 178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.407 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.0 OUTLIER -64.28 -25.15 67.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.09 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -76.85 -56.06 4.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.341 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.07 -27.91 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.491 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -76.03 -41.62 50.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.345 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 22.1 t -76.13 -48.59 27.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.523 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -49.16 -32.89 11.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.348 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -11.0 43.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.591 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.83 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -60.28 3.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.906 0.384 . . . . 0.0 111.05 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.1 mt -55.0 -29.64 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.501 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -56.26 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.293 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.39 -28.95 63.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.9 0.381 . . . . 0.0 110.957 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.508 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 3.2 mt -74.54 -21.56 59.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.539 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.11 -59.2 2.88 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.05 -42.39 49.68 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.4 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -80.88 -25.21 37.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.19 -57.57 12.23 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.83 -55.73 15.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.459 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.539 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.4 tt0 -47.94 -28.39 2.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.039 0.447 . . . . 0.0 111.246 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.411 ' CD2' ' CG2' ' A' ' 57' ' ' VAL . 12.1 tp -71.41 -38.29 71.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.454 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -58.28 6.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.536 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -27.8 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.348 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 1.8 tptt -70.38 -25.58 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.239 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.63 -37.26 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.839 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.25 -29.71 69.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.779 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 4.4 pt-20 -78.4 -30.51 47.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.559 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.4 mt . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.037 -179.946 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.755 0.312 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.9 p -52.85 -29.39 14.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.427 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.85 87.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.082 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -60.03 -57.09 14.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.066 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 24.4 t -55.79 -25.87 19.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.24 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.84 -37.84 87.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.35 . . . . 0.0 110.556 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.07 -27.98 63.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.795 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -70.61 -28.89 65.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.411 ' CG2' ' CD2' ' A' ' 37' ' ' LEU . 20.8 t -83.25 -25.56 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.054 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -28.64 60.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.4 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -39.67 54.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 3.5 tt -75.14 -25.25 58.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.481 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -56.1 8.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.951 0.405 . . . . 0.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.93 -26.96 67.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.494 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 2.2 mt-10 -61.66 -46.76 88.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 60' ' ' LEU . 17.2 mt -65.26 -24.2 34.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.01 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.31 -31.77 72.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.911 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 180.0 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.833 0.349 . . . . 0.0 111.117 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.93 -43.35 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.364 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -66.41 -19.87 65.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.423 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.67 -53.98 9.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.302 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.56 -29.23 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.723 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -37.23 74.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.8 40.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.47 0.653 . . . . 0.0 109.522 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.412 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.3 tt -65.51 -25.12 67.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.915 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.409 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.4 tt0 -75.28 -46.43 33.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.098 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.22 -27.71 23.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -41.31 50.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.088 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.3 t -78.14 -51.78 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.579 -179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -49.82 -31.1 11.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.49 -179.559 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -11.59 38.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.464 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.997 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 N-CA-C 112.611 -0.196 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -55.47 20.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.041 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mp -58.5 -29.67 39.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.717 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -56.21 21.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 0.0 111.299 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -26.82 64.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.191 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 5.6 mt -76.66 -21.68 55.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -78.56 -59.35 2.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -39.21 58.32 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -81.9 -24.96 35.39 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.07 -57.71 10.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.668 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.86 -46.45 71.69 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.411 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 6.0 tt0 -53.83 -28.17 34.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 0.0 110.835 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.7 tp -72.03 -41.78 67.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.388 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -58.18 9.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.538 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt -52.96 -28.54 24.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.351 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -29.89 68.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.103 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -74.47 -31.76 28.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.872 0.368 . . . . 0.0 110.671 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -68.83 -31.95 71.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.534 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -75.26 -29.65 60.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.446 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 6.1 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.969 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.63 0.252 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 t -51.53 -28.04 8.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.796 0.332 . . . . 0.0 111.454 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.74 -29.46 62.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.979 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -63.28 -57.17 11.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.5 t -61.12 -29.72 46.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.16 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -63.21 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.703 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -79.06 -27.67 43.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.895 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -69.27 -28.54 66.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.379 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.2 t -83.22 -25.87 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.116 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -75.23 -28.61 59.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -37.85 56.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.676 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.433 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 3.6 tt -76.93 -25.78 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.118 -0.233 . . . . 0.0 111.439 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.36 -56.08 9.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.988 0.423 . . . . 0.0 110.28 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -62.25 -26.78 68.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.776 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.451 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -60.27 -47.57 85.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.019 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 15.4 mt -66.37 -24.01 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.111 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -63.13 -33.99 76.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.717 179.896 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.146 0 CA-C-O 120.597 0.237 . . . . 0.0 111.496 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -83.06 -32.82 26.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.737 0.303 . . . . 0.0 111.404 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -76.2 -19.16 58.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.199 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.87 -46.97 14.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.009 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.9 t -72.51 -29.51 31.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.11 -35.42 80.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.934 0.397 . . . . 0.0 110.358 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.5 -23.76 37.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.496 0.665 . . . . 0.0 109.572 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tt -67.4 -25.22 65.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.004 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -77.2 -48.47 17.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.247 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.38 -25.88 10.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.188 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -76.06 -45.2 35.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.3 t -75.77 -51.04 21.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.458 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -52.2 -30.43 27.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.26 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.0 -11.45 35.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.287 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 112.836 -0.105 . . . . 0.0 112.836 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -27.91 11.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 111.289 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 59.9 mt -64.59 -29.82 48.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.167 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -59.75 -56.02 26.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.338 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.42 -36.72 71.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 0.0 111.282 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 7.1 mt -67.1 -21.86 65.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.643 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -78.54 -59.1 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -51.89 -59.09 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.816 0.341 . . . . 0.0 111.914 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.43 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -59.92 -24.99 64.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.698 -179.458 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.03 -57.75 11.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.536 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -67.25 -55.47 13.86 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.536 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.8 OUTLIER -47.98 -28.27 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 0.0 111.18 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.401 ' CD2' ' CG2' ' A' ' 57' ' ' VAL . 10.8 tp -70.51 -41.33 72.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.342 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -58.27 9.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.548 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -52.46 -27.98 18.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.242 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.07 -25.82 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.053 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.7 mt -74.07 -31.85 31.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.862 0.363 . . . . 0.0 110.67 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -67.95 -33.56 74.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.335 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -74.66 -28.59 60.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.737 179.612 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.449 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 7.8 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.108 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.728 0.299 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 p -49.46 -27.19 2.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.691 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -26.06 61.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.414 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -77.96 -57.39 3.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.206 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.3 t -57.5 -25.89 25.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.325 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -38.03 86.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 110.652 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.03 -27.79 62.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -72.06 -28.7 63.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.438 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.401 ' CG2' ' CD2' ' A' ' 37' ' ' LEU . 16.9 t -83.23 -27.35 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.224 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -28.71 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.76 -39.08 52.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.939 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.45 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.5 OUTLIER -78.14 -24.94 47.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.43 -54.27 13.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.985 0.422 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -64.03 -26.85 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.635 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 8.6 mm-40 -59.37 -57.7 11.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.468 HD11 HG23 ' A' ' 64' ' ' ILE . 29.6 mt -56.14 -25.6 20.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.24 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -28.09 65.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.017 -179.898 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.761 0.315 . . . . 0.0 111.213 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -68.08 -34.14 75.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.295 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -77.06 -19.79 56.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.409 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -42.74 67.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.346 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.4 -29.31 14.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.6 81.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.043 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.9 37.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.539 0.685 . . . . 0.0 109.59 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.99 -25.33 66.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.905 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.13 -50.7 11.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.091 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -49.42 -27.46 4.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.135 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -76.04 -40.54 53.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.907 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.404 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 16.0 t -78.32 -55.3 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -55.2 -22.08 16.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.64 -16.09 27.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.408 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.3 pp . . . . . 0 C--N 1.332 -0.189 0 CA-C-O 120.89 0.376 . . . . 0.0 110.817 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.568 -0.213 . . . . 0.0 112.568 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -27.76 64.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 111.018 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.4 mt -68.06 -29.8 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.219 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.51 -56.12 21.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.178 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.57 -29.51 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.837 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.525 ' CD2' ' HB3' ' A' ' 63' ' ' GLU . 9.5 mt -72.08 -22.28 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.325 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -78.61 -59.16 2.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -58.87 5.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.794 0.331 . . . . 0.0 111.838 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 ttpm? -60.37 -25.05 65.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.75 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.38 -57.57 11.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.639 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.532 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.36 -55.44 10.4 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.546 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.532 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.01 -28.62 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.006 0.431 . . . . 0.0 111.141 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.02 -38.24 75.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.165 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -58.02 8.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.375 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptmt -50.25 -31.78 14.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.378 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -66.76 -25.98 66.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 mt -74.13 -32.41 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 0.0 110.625 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -67.35 -36.34 81.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -71.02 -29.78 65.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.483 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.446 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 9.1 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.794 0.331 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.3 p -50.1 -28.33 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.53 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.62 -31.55 67.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.068 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -66.42 -57.25 7.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.0 t -58.99 -25.9 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.126 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -38.36 89.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -71.71 -27.88 63.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.638 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -69.75 -28.94 66.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.928 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.49 -25.45 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -74.58 -28.38 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.437 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.61 -43.44 48.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.503 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.463 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 1.7 tt -72.51 -25.04 61.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.59 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -69.76 -56.14 7.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.936 0.398 . . . . 0.0 110.557 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.49 -26.94 65.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.807 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.525 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.32 -48.41 78.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.943 -179.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.409 ' CG1' HD23 ' A' ' 30' ' ' LEU . 15.6 mt -65.75 -24.16 33.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.861 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -35.33 76.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.989 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.899 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.757 0.313 . . . . 0.0 111.283 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -78.68 -32.57 47.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -20.47 56.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -74.81 -55.04 6.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.897 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.1 t -63.91 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.267 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -59.23 -36.84 76.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.438 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.95 -23.89 44.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.531 0.682 . . . . 0.0 109.414 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tt -66.85 -24.99 66.2 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.856 -1.066 . . . . 0.0 110.86 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.425 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 34.3 tt0 -74.19 -49.77 22.11 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.63 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -50.71 -26.02 5.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.757 0.313 . . . . 0.0 111.341 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -75.11 -43.91 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.173 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.436 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 3.0 t -77.94 -56.26 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.334 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 22.2 mttt -51.82 -24.11 5.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.301 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.52 -18.81 28.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.142 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.3 pp . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.808 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.404 ' HD3' HG13 ' A' ' 27' ' ' ILE . 0.2 OUTLIER -56.56 -27.63 58.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.104 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.404 HG13 ' HD3' ' A' ' 26' ' ' ARG . 61.4 mt -74.19 -29.69 25.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.502 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -56.15 15.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.759 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -61.19 -37.58 83.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.417 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 71.5 mt -67.54 -21.41 65.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.801 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -78.03 -59.29 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -53.59 -34.8 59.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.748 0.308 . . . . 0.0 111.777 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.443 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.02 -24.78 35.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.823 -179.404 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.96 -58.0 8.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.03 -46.4 68.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.876 -178.809 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 3.5 tt0 -55.05 -28.17 50.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.057 0.456 . . . . 0.0 110.789 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 tp -69.33 -42.44 75.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.328 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -58.17 9.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.4 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -49.97 -32.8 15.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.444 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -66.46 -26.84 67.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.46 HG21 HD12 ' A' ' 41' ' ' ILE . 8.4 mt -74.81 -32.39 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.569 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.65 -33.18 74.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.413 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.42 -29.79 61.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.509 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.458 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 7.8 mt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 . . . . . 0 CA--C 1.527 0.089 0 CA-C-O 120.699 0.285 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.74 -29.56 7.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.482 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -66.17 -31.0 71.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.029 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.2 tptp -66.33 -57.25 7.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 44.8 t -55.49 -26.01 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.202 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.93 -36.58 84.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.57 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -73.79 -27.84 61.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.723 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -69.53 -28.69 66.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 t -82.76 -25.71 8.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.115 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.35 -28.38 59.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.597 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.08 -41.19 62.08 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.443 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.12 -26.17 47.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.54 -42.22 68.17 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.962 0.41 . . . . 0.0 110.735 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 65' ' ' LYS . 4.4 tt0 -74.26 -26.38 60.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.5 OUTLIER -64.38 -59.2 4.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.405 -179.531 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.414 HG21 HD12 ' A' ' 64' ' ' ILE . 37.9 mt -51.29 -26.58 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.044 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 2.4 mptp? -52.9 -38.72 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.408 179.529 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.737 0.303 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -74.48 -30.4 61.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.496 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.01 -24.77 52.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -52.5 38.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.813 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.06 -29.21 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.351 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.06 75.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.78 -24.48 38.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 109.56 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.411 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.9 tt -64.99 -24.94 67.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.941 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.38 -55.34 5.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.607 -179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -46.8 -27.72 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.513 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -76.1 -40.5 52.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.313 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.1 t -78.19 -45.48 26.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.484 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.22 -29.91 6.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.495 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.55 -13.23 37.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.472 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.978 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 N-CA-C 112.519 -0.232 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.402 ' HD2' ' CD1' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.96 -28.13 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 0.0 110.771 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.5 mt -67.78 -29.72 46.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.243 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -52.78 60.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.108 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -57.64 -30.39 65.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.923 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 1.0 OUTLIER -71.5 -21.86 61.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.306 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -78.09 -59.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.998 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.75 69.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.823 0.344 . . . . 0.0 111.809 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -24.94 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.809 -179.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.93 -57.96 8.99 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.631 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.85 -47.07 66.87 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -178.432 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.417 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.7 OUTLIER -55.07 -28.09 49.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.096 0.474 . . . . 0.0 110.844 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.405 ' CD2' ' HA ' ' A' ' 57' ' ' VAL . 7.1 tp -72.92 -39.0 66.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.431 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -53.08 62.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.451 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -27.99 68.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.384 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.09 -27.14 67.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.281 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.47 -33.59 23.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.881 0.372 . . . . 0.0 110.666 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.45 -31.46 72.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.21 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -77.11 -29.41 54.81 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.441 179.644 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.468 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 23.6 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.002 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.705 0.288 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.3 t -53.34 -27.89 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.396 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -28.54 67.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.044 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.25 -57.17 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.936 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.47 -27.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.481 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -63.27 -30.99 72.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.983 0.421 . . . . 0.0 110.687 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -80.97 -27.83 35.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.831 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -67.95 -28.72 67.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.405 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . 21.2 t -81.05 -25.84 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.969 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.01 -28.42 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.332 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.25 -37.15 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.451 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 4.0 tt -76.08 -28.67 57.67 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.087 -0.245 . . . . 0.0 111.393 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.5 -56.13 12.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.917 0.389 . . . . 0.0 110.652 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -62.26 -26.79 68.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.841 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.48 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -61.82 -43.19 99.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.028 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.459 HG23 HD12 ' A' ' 64' ' ' ILE . 17.5 mt -65.72 -24.53 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.208 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.1 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.888 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.831 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.44 -33.11 66.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.381 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -19.6 56.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.534 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.12 -43.2 24.55 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 17.6 t -76.91 -29.39 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -63.07 -35.24 79.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.973 0.416 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.28 -26.76 35.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.606 0.717 . . . . 0.0 109.503 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.15 -25.46 68.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.814 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -76.86 -45.11 29.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.196 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.43 -29.03 22.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.143 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -45.95 30.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.9 t -70.87 -51.57 34.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.527 -179.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -31.01 13.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.364 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.2 -13.33 38.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.387 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.49 -62.03 2.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 0.0 110.875 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.6 mt -51.04 -29.15 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.952 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -60.04 -56.35 22.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -56.61 19.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.979 0.419 . . . . 0.0 111.365 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.48 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 37.5 mt -53.01 -21.02 3.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.467 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.9 -59.25 2.86 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -39.15 58.64 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -80.77 -24.67 38.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.282 -0.417 . . . . 0.0 112.12 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.3 -57.77 9.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.649 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -68.54 -47.76 66.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.036 -178.687 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.421 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -54.43 -28.19 42.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.064 0.459 . . . . 0.0 110.973 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.39 -41.71 72.66 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.313 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -58.98 -58.08 10.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.352 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.31 -28.02 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -26.31 63.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -74.22 -32.55 32.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.969 0.414 . . . . 0.0 110.628 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.61 -33.98 76.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.515 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.45 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -73.72 -29.26 62.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.646 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.45 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 6.2 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.979 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.701 0.286 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -48.91 -30.64 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.447 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -29.9 65.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.917 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -66.71 -57.19 7.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.878 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.57 -29.51 29.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.141 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.25 -33.59 74.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.623 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -76.85 -28.01 55.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.786 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -67.58 -28.82 68.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.965 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.9 t -83.03 -25.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.998 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -74.11 -28.21 61.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.486 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.54 -41.45 54.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.91 -25.73 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.45 -53.96 14.26 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.991 0.424 . . . . 0.0 110.628 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -64.39 -26.89 68.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.185 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.4 mm-40 -61.9 -59.08 5.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.258 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.5 mt -54.28 -25.45 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -53.0 -38.64 62.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.724 0.297 . . . . 0.0 111.438 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.6 mttp . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.864 0.364 . . . . 0.0 110.951 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.754 0.312 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -72.44 -31.34 65.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.596 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.25 -21.92 52.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.725 0.298 . . . . 0.0 111.378 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -54.98 9.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.235 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.76 -29.21 44.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.419 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -59.5 -36.65 76.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.634 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.03 -23.99 38.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.6 0.714 . . . . 0.0 109.541 178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.24 -25.23 67.58 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.819 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -75.84 -46.02 32.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.012 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -53.17 -27.1 19.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.207 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -49.19 18.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.7 t -70.08 -55.2 15.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.376 -179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -52.67 -24.53 8.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.492 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.92 -19.12 26.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.433 ' CD1' ' C ' ' A' ' 21' ' ' LEU . 1.6 tm? . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.248 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -61.41 2.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.014 0.435 . . . . 0.0 110.922 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.415 ' CG1' HD13 ' A' ' 21' ' ' LEU . 2.0 mp -51.75 -29.46 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.911 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -56.18 25.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.49 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.422 . . . . 0.0 110.962 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 2.4 mt -69.2 -21.27 63.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.618 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -77.72 -59.19 2.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -54.1 32.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.352 . . . . 0.0 111.583 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.409 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 9.3 tttp -65.1 -25.07 67.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.784 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.5 -57.53 12.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.476 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.08 -52.34 43.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.8 tm-20 -49.49 -28.38 5.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 111.106 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.7 tp -71.87 -41.89 67.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -58.29 9.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.707 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -33.02 9.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.636 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 tttt -67.85 -27.19 66.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.165 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -76.0 -31.49 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.868 0.366 . . . . 0.0 110.752 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -69.69 -31.41 69.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.6 pt-20 -76.05 -29.6 58.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.529 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 8.3 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.768 0.318 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -54.35 -28.73 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.351 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -66.06 -32.84 74.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.153 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -69.69 -57.34 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.994 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.4 t -52.87 -25.81 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.432 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -65.87 -38.06 87.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.719 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -72.06 -27.78 62.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.84 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.84 -29.11 65.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.136 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.8 t -83.28 -25.85 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.116 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -75.31 -28.5 59.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.51 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -38.59 55.91 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.441 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.0 -25.34 47.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.616 0.246 . . . . 0.0 111.627 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -54.18 15.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.065 0.459 . . . . 0.0 110.466 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 -26.84 68.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.923 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.468 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.85 -51.19 70.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.166 -179.746 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.429 ' CG1' ' CD2' ' A' ' 30' ' ' LEU . 19.4 mt -62.03 -24.64 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.114 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -66.07 -31.87 73.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.969 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.6 mttm . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.894 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.789 0.328 . . . . 0.0 111.168 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -78.73 -39.98 34.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.323 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -19.97 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.381 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -53.76 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.192 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.6 t -64.31 -29.31 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.41 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -37.1 75.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.729 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 -23.93 41.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.511 0.672 . . . . 0.0 109.517 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.22 -25.28 67.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.707 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -79.09 -47.4 16.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.079 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -51.36 -30.64 19.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.899 0.381 . . . . 0.0 111.082 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.4 tttm -76.15 -38.04 57.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.409 ' HA ' ' CD2' ' A' ' 21' ' ' LEU . 20.0 t -78.12 -56.26 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.399 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -52.74 -24.62 9.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.243 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -18.75 26.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.98 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.409 ' CD2' ' HA ' ' A' ' 18' ' ' VAL . 1.2 pp . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -37.27 72.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.864 0.364 . . . . 0.0 110.913 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.7 mt -63.41 -29.73 47.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.867 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.92 -56.18 17.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.628 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -27.09 67.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 96.5 mt -76.83 -21.54 54.89 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.552 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -78.33 -59.35 2.82 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -53.34 -36.24 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 111.727 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.77 35.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.842 -179.265 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.8 -57.71 9.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -44.94 72.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.885 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -55.34 -28.04 51.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.161 0.505 . . . . 0.0 110.776 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.97 -42.2 70.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.337 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -57.96 -58.19 9.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.537 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -51.69 -28.36 14.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -70.74 -26.9 63.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.013 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.429 HG22 HD11 ' A' ' 41' ' ' ILE . 6.9 mt -77.73 -29.56 16.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.867 0.365 . . . . 0.0 110.749 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -38.98 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.423 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.7 pt-20 -68.17 -35.21 77.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.347 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.419 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 7.0 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.024 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.581 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 4.8 tt0 . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.62 0.247 . . . . 0.0 111.533 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.78 -14.69 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.706 0.288 . . . . 0.0 111.234 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -52.92 11.43 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -54.81 -57.2 12.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 t -55.66 -31.31 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.806 0.336 . . . . 0.0 111.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -61.95 -32.7 73.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -77.37 -27.74 52.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.841 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.02 -29.94 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.5 t -83.31 -25.56 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.179 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -28.18 61.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.376 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -37.83 59.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.757 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.472 ' O ' HG13 ' A' ' 64' ' ' ILE . 1.1 tt -78.09 -25.7 47.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.759 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.29 -55.53 8.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 110.496 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.28 -26.89 68.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.919 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 5.1 mt-10 -62.58 -49.35 75.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.464 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 60' ' ' LEU . 25.7 mt -58.21 -27.75 33.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.075 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -67.35 -30.35 70.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.898 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.959 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.726 0.298 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -74.53 -33.43 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.548 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.94 -19.72 57.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.21 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -42.79 47.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.143 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.9 t -74.12 -29.42 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.379 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -62.08 -36.02 80.41 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.347 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.22 -24.49 37.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.463 0.649 . . . . 0.0 109.54 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.4 tt -65.74 -25.24 67.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.745 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 35.6 tt0 -74.17 -40.31 62.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.167 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -53.63 -28.61 33.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.196 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 tptt -76.06 -43.8 42.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.97 -52.56 20.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.373 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.3 mttm -49.12 -31.71 8.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.321 . . . . 0.0 111.577 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.14 -12.28 61.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.499 ' N ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.297 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.26 -27.8 4.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.72 0.295 . . . . 0.0 111.229 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.411 ' CG2' ' HG ' ' A' ' 21' ' ' LEU . 55.6 mt -65.01 -29.95 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.441 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -62.22 -56.06 22.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -58.84 -27.0 64.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.894 0.378 . . . . 0.0 110.836 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.498 ' CD2' ' HB3' ' A' ' 63' ' ' GLU . 4.9 mt -73.71 -23.4 59.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.292 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -78.32 -59.43 2.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -36.98 45.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.425 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.93 35.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.022 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.43 -57.85 8.1 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -178.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -43.51 73.8 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.29 -28.2 64.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.029 0.442 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tp -69.13 -48.3 62.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.458 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -58.25 8.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.532 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -29.03 30.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.399 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.4 tttm -70.04 -26.25 63.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.123 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.2 mt -76.76 -32.34 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 0.0 110.712 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -69.0 -32.57 72.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.443 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.32 -29.97 60.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.518 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.476 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.2 mt . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.963 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.632 0.253 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.1 t -56.0 -21.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.609 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -75.61 -25.95 57.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -78.01 -57.31 3.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.108 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.8 t -57.45 -29.8 34.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.369 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -38.57 90.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 110.649 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.69 -27.68 63.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.862 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.59 -29.28 66.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.307 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.4 t -83.21 -25.77 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.919 0.39 . . . . 0.0 111.187 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.84 -28.31 60.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.275 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmt? -75.16 -41.01 59.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.76 -179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.488 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 2.1 tt -73.59 -27.64 61.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.642 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.58 -56.04 11.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.885 0.374 . . . . 0.0 110.789 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.11 -26.93 68.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.498 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.91 -49.38 75.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.389 -179.485 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 16.8 mt -63.82 -24.46 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.755 0.312 . . . . 0.0 111.313 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.7 mmtt -55.99 -37.66 69.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.131 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.699 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.771 0.319 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -73.33 -33.35 65.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.078 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -77.2 -20.01 55.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.302 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -45.63 65.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.255 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 t -75.91 -29.42 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.475 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -35.86 81.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.979 0.419 . . . . 0.0 110.173 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -24.06 37.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.515 0.674 . . . . 0.0 109.467 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.417 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -66.05 -25.15 66.92 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.915 179.426 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.85 -56.13 4.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.365 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -47.04 -29.52 2.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.366 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -76.04 -39.53 55.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.003 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -78.09 -51.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.326 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -51.21 -29.87 15.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.408 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.93 -11.78 35.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.327 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.868 0.366 . . . . 0.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.88 -27.77 60.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 111.02 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -70.14 -29.66 40.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.282 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -56.09 22.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.75 68.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 9.3 mt -71.16 -21.62 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.612 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -78.53 -58.97 2.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.08 -59.04 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 4.1 ttpm? -61.22 -25.06 66.8 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.936 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.21 -57.63 11.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.34 -55.41 16.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.511 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.541 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 33.7 tt0 -48.47 -28.51 3.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.983 0.421 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.409 ' CD2' ' CG2' ' A' ' 57' ' ' VAL . 10.9 tp -70.32 -42.63 71.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.805 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -58.49 6.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 111.739 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.23 -27.94 10.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.513 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 7.9 ttpt -70.73 -28.22 64.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.093 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.14 -32.76 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.659 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.09 -33.38 74.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.344 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.4 pt-20 -73.98 -29.73 62.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.451 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 9.8 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.009 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.779 0.324 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.28 -19.66 16.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.519 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -70.65 -35.06 72.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -73.56 -57.15 4.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 38.7 t -53.14 -25.96 10.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.309 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -35.83 82.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.609 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -74.54 -27.88 60.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.73 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -70.12 -28.73 65.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.409 ' CG2' ' CD2' ' A' ' 37' ' ' LEU . 15.9 t -83.1 -25.83 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -75.27 -28.42 59.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.533 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -76.06 -38.56 56.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.449 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.18 -25.09 47.0 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.598 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -54.18 15.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.001 0.429 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -64.76 -26.83 68.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.651 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.443 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -58.78 -56.2 25.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.9 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 23.5 mt -59.15 -24.5 27.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.187 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -31.54 72.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.88 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 mttm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 179.972 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -75.12 -32.54 61.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.243 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -77.19 -20.68 55.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.245 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -68.86 -51.0 45.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.016 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.7 t -71.57 -29.14 33.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.492 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.9 ttpt -60.86 -36.38 79.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.441 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.1 -24.67 37.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.409 0.623 . . . . 0.0 109.559 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tt -65.49 -25.4 67.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.892 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.439 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.7 tt0 -77.71 -47.76 18.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.25 -29.57 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.319 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -76.14 -40.01 53.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 10.1 t -78.01 -59.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.997 0.427 . . . . 0.0 111.235 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -51.49 -22.82 3.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.99 -18.28 29.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.379 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.5 pp . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.911 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.569 -0.212 . . . . 0.0 112.569 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.67 -62.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.111 0.481 . . . . 0.0 110.842 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.9 mt -55.42 -29.55 24.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.803 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -56.24 20.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.666 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.16 -41.12 87.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.991 0.424 . . . . 0.0 110.853 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.525 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 2.9 mt -59.41 -21.13 59.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.702 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.4 -59.0 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -59.05 4.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.886 0.374 . . . . 0.0 111.691 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.427 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 1.3 ttpt -61.21 -24.86 66.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.845 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.525 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.38 -57.5 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.52 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.34 -54.63 16.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -178.471 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.52 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.52 -28.3 3.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.02 0.438 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 tp -69.13 -41.48 77.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.468 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -58.26 8.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.44 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -52.02 -27.93 15.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.409 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.25 -29.07 67.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.047 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.466 HD13 HG22 ' A' ' 41' ' ' ILE . 7.7 mt -75.2 -32.59 26.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 0.0 110.602 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -31.3 71.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.394 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.1 OUTLIER -76.37 -29.93 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.473 179.673 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.461 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 9.4 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.976 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.748 0.308 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -56.01 -26.3 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -62.93 -32.15 73.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.054 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.17 -57.19 13.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.85 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.46 -25.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.209 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.17 -32.92 74.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -27.85 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -70.08 -28.72 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.9 t -83.22 -25.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.062 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -28.63 59.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.587 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.24 -37.77 57.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.427 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 1.4 tt -78.04 -25.24 47.71 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.581 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -55.44 10.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.051 0.453 . . . . 0.0 110.268 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -63.56 -26.88 68.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.813 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.465 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 11.9 mm-40 -60.11 -50.99 71.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.976 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.42 ' CG1' ' CD2' ' A' ' 30' ' ' LEU . 22.1 mt -61.74 -24.18 33.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.17 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -30.66 71.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.023 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 28.7 mttt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.908 179.86 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.831 0.348 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.56 -31.21 53.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.549 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.15 -22.4 52.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.714 0.292 . . . . 0.0 111.254 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -54.36 8.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 t -65.79 -29.41 46.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.492 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -59.03 -36.78 75.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.68 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.28 -23.97 40.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.488 0.661 . . . . 0.0 109.336 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -25.25 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.82 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -78.34 -41.98 31.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.212 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -55.14 -30.98 60.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.031 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -76.08 -42.84 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.25 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.9 t -73.43 -52.55 21.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.475 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -50.01 -31.07 11.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.22 -10.89 36.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.36 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.936 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -44.01 86.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.94 -29.57 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.58 -56.35 23.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.708 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.68 -47.02 85.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.933 0.397 . . . . 0.0 111.182 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 76.4 mt -57.87 -21.06 41.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.86 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -74.51 -59.1 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -50.9 -46.81 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.76 -24.66 60.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.095 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.07 -57.78 9.5 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.497 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -70.29 -52.45 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.767 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.497 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.2 tm-20 -50.18 -28.2 7.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.159 0.504 . . . . 0.0 110.937 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 tp -69.86 -43.68 71.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.224 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.81 -58.29 9.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.314 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -52.62 -27.9 19.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.331 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 -25.78 63.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.216 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.2 mt -79.35 -32.81 15.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 111.042 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -66.65 -38.73 87.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.738 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -70.33 -37.54 74.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.2 mt . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.049 -179.967 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.728 0.299 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -49.06 -29.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.519 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -71.98 -29.44 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -69.12 -57.34 5.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.069 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.6 t -56.85 -29.55 30.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.08 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -61.38 -40.41 94.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.49 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.93 -27.82 65.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.682 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -68.52 -28.66 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.006 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.5 t -82.76 -25.86 8.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.078 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt -75.12 -28.18 60.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.513 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -75.65 -38.39 58.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.22 -25.77 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -51.35 26.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.017 0.437 . . . . 0.0 110.738 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -67.64 -26.65 66.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.217 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.432 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.74 -59.06 5.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.434 -179.422 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 35.3 mt -50.31 -28.39 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.536 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -27.48 65.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.733 0.301 . . . . 0.0 110.895 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.672 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.821 0.343 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -67.62 -32.93 73.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -77.27 -20.1 55.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.734 0.302 . . . . 0.0 111.312 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -43.56 58.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.41 -29.3 21.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.475 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -62.75 -35.83 81.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 0.0 110.182 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 -23.86 37.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.549 0.69 . . . . 0.0 109.499 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.38 -25.49 66.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.875 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.93 -51.54 13.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.207 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -51.3 -27.33 9.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.128 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -76.05 -40.94 52.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.832 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.434 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 19.1 t -78.08 -52.6 15.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.068 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -55.55 -19.92 11.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.33 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.75 -17.57 26.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.43 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.5 pp . . . . . 0 C--N 1.331 -0.205 0 CA-C-O 120.86 0.362 . . . . 0.0 110.808 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -27.62 61.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.745 0.307 . . . . 0.0 111.063 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -66.04 -29.73 47.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.464 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.21 -56.14 12.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.484 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -59.16 -26.87 65.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.78 0.324 . . . . 0.0 111.369 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 92.1 mt -79.56 -21.61 44.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.72 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -76.74 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.67 -51.55 55.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 111.742 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -66.74 -25.12 66.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.844 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.09 -57.62 11.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.533 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.06 -55.3 14.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 112.057 -178.672 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.533 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.23 -28.44 3.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.061 0.458 . . . . 0.0 111.336 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 tp -69.07 -41.7 77.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.486 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -58.17 8.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.628 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -52.1 -27.96 15.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.47 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 22.1 tttt -70.58 -25.56 63.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.446 HG23 HD13 ' A' ' 41' ' ' ILE . 6.9 mt -77.11 -40.79 30.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 111.089 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -65.89 -28.89 69.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.812 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 5.5 pt-20 -77.68 -30.92 52.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.375 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.935 179.916 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.778 0.323 . . . . 0.0 110.963 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.6 t -56.11 -22.79 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.41 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.95 -29.89 55.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.897 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.03 -57.27 6.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.95 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.8 t -60.19 -29.87 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.51 -33.27 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.645 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -27.89 53.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.794 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -67.9 -29.21 68.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.26 -25.61 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.032 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -73.44 -28.15 61.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.35 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.4 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -74.07 -24.98 59.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.054 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -56.0 8.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.937 0.399 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -61.35 -26.99 68.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.153 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.406 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.3 tm-20 -61.99 -58.93 6.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.103 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.443 HD12 HG21 ' A' ' 64' ' ' ILE . 31.5 mt -52.89 -25.2 8.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.269 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.5 mttp . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 179.93 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.699 0.285 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -74.39 -35.8 63.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.694 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.61 -19.7 60.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.704 0.288 . . . . 0.0 111.523 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -73.07 -51.04 19.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.202 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.4 -29.21 43.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.648 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -36.71 77.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.99 -23.92 38.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.532 0.682 . . . . 0.0 109.508 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.31 -25.14 67.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.834 179.271 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -75.1 -44.95 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.54 -26.12 12.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.99 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -76.08 -54.45 6.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.4 t -65.0 -53.45 41.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.261 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -53.58 -26.55 22.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.22 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.69 -10.91 38.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.46 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.626 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.66 61.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.739 0.304 . . . . 0.0 111.07 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.5 mt -73.94 -29.61 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.293 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -65.05 -56.14 14.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.599 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.46 -35.14 76.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 0.0 111.202 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 96.0 mt -69.97 -21.42 63.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.659 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -76.64 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.628 0.251 . . . . 0.0 111.577 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.34 -37.08 62.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.581 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.48 -24.84 45.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.746 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -57.95 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -40.5 90.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.079 -178.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.12 -28.21 69.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 111.081 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.415 HD11 ' HA ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -70.18 -55.1 10.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.673 -179.107 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.96 -58.11 6.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 111.596 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.0 -27.92 8.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.413 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -71.09 -28.46 64.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.999 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.9 mt -75.07 -31.35 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.636 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.92 -34.45 75.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -72.59 -29.76 63.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.461 179.559 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.456 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.6 mt . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.945 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.832 0.348 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 p -52.55 -30.65 14.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.33 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -60.57 -27.14 67.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.139 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -68.52 -57.25 6.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.063 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.9 t -53.68 -26.08 12.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -65.2 -32.6 74.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.482 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.56 -27.94 51.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.705 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -68.62 -28.85 67.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.574 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.415 ' HA ' HD11 ' A' ' 37' ' ' LEU . 2.5 t -83.09 -25.52 8.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.894 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -28.18 61.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.527 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -75.27 -43.32 51.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.91 -25.15 58.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -54.1 12.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -62.87 -27.02 69.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.108 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.411 ' CG ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.7 -59.0 5.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.438 HD13 HG23 ' A' ' 64' ' ' ILE . 29.9 mt -55.16 -26.15 17.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -61.72 -34.23 75.42 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.879 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.8 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.528 0.102 0 CA-C-O 120.734 0.302 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -79.01 -39.71 33.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -19.75 62.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.4 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -53.9 15.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.42 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.54 -29.3 46.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.754 -179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -59.48 -36.71 76.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.628 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.42 -23.83 40.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.576 0.703 . . . . 0.0 109.393 178.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -25.26 67.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.912 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -77.33 -52.89 8.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.241 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -49.99 -27.95 6.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.894 0.378 . . . . 0.0 111.197 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -76.09 -42.74 46.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.8 t -76.41 -48.44 27.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 -179.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.02 -32.38 15.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.273 -179.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.1 -10.82 40.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.45 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.895 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.621 -0.192 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -27.72 62.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.76 0.314 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 59.2 mt -67.65 -29.72 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.368 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.45 -56.18 12.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.659 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.63 -27.56 66.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.297 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 84.5 mt -78.87 -21.58 47.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.749 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.0 -58.66 3.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.715 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.35 -43.28 61.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.758 0.313 . . . . 0.0 111.824 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HB3' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -75.06 -24.86 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.015 -179.239 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.25 -57.78 9.32 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.733 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.409 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.7 -46.54 68.72 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.409 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -54.22 -28.07 38.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.075 0.464 . . . . 0.0 110.855 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.8 tp -70.88 -42.74 69.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.529 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.3 9.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.797 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -51.34 -27.76 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.661 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -25.97 60.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.296 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 10.0 mt -71.26 -57.03 8.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.8 0.333 . . . . 0.0 110.681 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -23.93 64.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.128 0.49 . . . . 0.0 110.038 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -86.33 -12.98 47.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.206 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 2.2 mt . . . . . 0 C--N 1.331 -0.21 0 CA-C-O 120.914 0.388 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.761 0.315 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.1 t -55.34 -24.65 15.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.37 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -28.77 58.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.932 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -57.41 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.87 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 t -62.59 -26.02 39.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -67.09 -34.66 78.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.615 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.56 -27.96 58.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.798 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.57 -28.94 65.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.009 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.13 -25.84 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.168 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -28.48 59.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.655 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.31 -42.01 46.67 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.404 HD11 ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -75.48 -25.0 57.0 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.261 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.06 -55.35 9.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.984 0.421 . . . . 0.0 110.552 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.64 -27.0 68.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.242 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -59.11 5.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.283 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 30.3 mt -54.42 -26.41 15.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.211 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -33.35 75.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.1 mmtt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 179.992 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.144 0 CA-C-O 120.706 0.289 . . . . 0.0 111.358 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -83.09 -35.55 25.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.355 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -73.13 -19.72 61.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -55.05 8.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.991 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.3 t -63.89 -29.37 47.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.277 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -36.97 75.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -23.98 41.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.461 0.648 . . . . 0.0 109.635 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tt -65.39 -25.45 67.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.721 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.411 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 36.3 tt0 -77.0 -40.57 46.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.246 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -54.29 -27.94 38.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -76.21 -47.67 23.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.55 -53.31 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.445 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.411 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.0 mttt -50.05 -30.82 11.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.478 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.21 -10.99 60.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.541 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.503 ' N ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.456 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.253 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -43.53 65.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.048 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.401 ' CG2' ' HG ' ' A' ' 21' ' ' LEU . 3.6 mt -59.7 -29.41 42.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.754 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -56.27 24.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -58.25 -38.59 77.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.453 . . . . 0.0 111.187 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 16.2 mt -66.15 -21.09 66.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.657 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -75.45 -55.93 5.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -53.83 -51.45 63.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.735 0.302 . . . . 0.0 111.606 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -25.05 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.931 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.86 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.04 -54.27 19.61 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.516 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.2 tt0 -48.53 -28.37 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.062 0.458 . . . . 0.0 111.19 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.87 -41.14 78.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.259 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -61.7 -58.27 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.15 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -27.98 25.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -68.9 -27.43 65.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.967 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -73.88 -31.06 29.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.903 0.382 . . . . 0.0 110.653 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -69.56 -34.6 74.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.423 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -72.53 -29.1 63.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.6 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.427 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.4 mt . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.994 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.695 0.283 . . . . 0.0 111.191 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.22 -16.92 17.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.565 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.19 -33.21 65.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.796 0.332 . . . . 0.0 111.098 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -65.99 -57.28 8.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.89 -25.73 33.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.216 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.32 -37.28 85.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.72 -27.74 62.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -70.67 -29.7 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.031 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -83.33 -25.87 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.204 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -75.34 -28.42 59.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.667 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -41.28 57.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -26.16 47.61 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.53 -49.38 48.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.088 0.47 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.11 -26.82 65.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.4 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.402 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -63.41 -59.1 5.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.29 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.403 HD11 HG21 ' A' ' 64' ' ' ILE . 39.6 mt -50.58 -28.41 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.387 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -64.43 -31.49 72.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.628 179.882 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.743 0.306 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -82.24 -37.99 25.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.58 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.05 -19.87 62.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.782 0.325 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -52.84 10.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.896 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.71 -29.19 45.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.426 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -37.26 73.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.774 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 -24.34 40.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.477 0.656 . . . . 0.0 109.611 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.404 HD22 HD23 ' A' ' 60' ' ' LEU . 3.2 tt -65.36 -25.18 67.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.761 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.429 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 56.8 tt0 -79.09 -42.72 25.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.353 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -53.7 -27.54 28.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.105 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 tppt? -76.16 -48.36 20.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.249 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.2 t -70.78 -49.6 49.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.618 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 10.2 mttt -51.24 -31.73 21.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.798 0.333 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.32 -10.85 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.419 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.664 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -27.54 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.798 0.333 . . . . 0.0 111.023 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.3 mt -73.55 -29.61 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.467 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -56.18 18.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.684 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.91 -42.82 94.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.392 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 53.7 mt -63.63 -21.41 66.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.811 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -75.81 -59.08 2.91 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.2 tttp -50.59 -56.32 12.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.768 0.318 . . . . 0.0 111.753 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.418 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.74 -24.99 67.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.767 -179.422 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.04 -57.88 10.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.555 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.14 -56.44 9.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.072 -178.498 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.555 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -47.94 -28.36 2.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.388 . . . . 0.0 111.412 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 tp -67.54 -39.88 85.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.344 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -58.2 5.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.469 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.424 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -52.89 -27.68 19.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.341 -179.743 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -68.5 -28.73 67.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 mt -73.63 -31.0 30.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.657 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.19 -33.93 74.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.466 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -73.24 -29.2 62.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.62 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.438 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.7 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.901 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.706 0.289 . . . . 0.0 111.118 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -53.37 -24.69 9.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.439 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -72.43 -36.5 68.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.89 0.376 . . . . 0.0 110.973 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -62.96 -57.23 11.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.3 t -57.93 -28.05 32.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.372 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.46 -36.24 83.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 110.728 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.34 -27.73 60.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.969 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.27 -29.26 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.377 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.5 t -83.27 -26.67 7.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.347 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.47 -28.38 59.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.691 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -76.79 -40.77 47.02 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.418 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.08 -25.81 47.84 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.978 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 -52.41 17.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.878 0.371 . . . . 0.0 110.55 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.46 -26.97 68.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.085 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.48 -59.13 5.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 35.2 mt -55.01 -25.69 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.254 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.02 -31.85 61.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.369 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.236 -179.635 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.736 0.303 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' CG2' ' A' ' 41' ' ' ILE . 53.7 mt-10 -75.5 -37.0 60.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -19.95 60.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.432 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.22 -48.81 40.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.006 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.64 -29.3 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.514 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.0 -36.52 77.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.458 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -23.86 40.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.639 0.733 . . . . 0.0 109.407 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.4 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.71 -25.22 67.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.982 179.38 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -75.87 -55.33 5.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.398 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -47.14 -30.91 3.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -37.94 57.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.769 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.4 t -78.15 -48.66 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.303 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -31.55 17.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.335 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.16 -10.98 39.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.542 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.841 0.353 . . . . 0.0 110.909 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -27.81 69.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -65.42 -29.76 48.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.501 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -64.66 -56.25 15.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.661 -179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.06 -26.89 66.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.727 0.298 . . . . 0.0 111.226 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 87.9 mt -77.21 -21.77 53.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.517 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -59.44 2.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.688 0.28 . . . . 0.0 111.724 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.03 -37.82 61.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.786 0.327 . . . . 0.0 111.722 -179.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.77 -24.87 41.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.831 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.7 -57.96 8.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.794 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.04 74.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.552 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -27.98 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.189 0.519 . . . . 0.0 110.561 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -76.55 -38.9 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.536 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -28.48 69.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.107 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -79.05 -27.63 43.13 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -73.13 -34.18 65.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.49 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 HD12 ' A' ' 41' ' ' ILE . 12.3 mt -67.37 -57.7 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.721 0.296 . . . . 0.0 110.701 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -58.28 -23.97 57.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.195 0.521 . . . . 0.0 110.044 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -84.81 -12.88 52.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.162 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 4.2 mt . . . . . 0 C--O 1.231 0.128 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.748 0.309 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.69 -22.19 14.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.417 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -72.99 -29.73 63.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.1 -57.29 6.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.867 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.91 -28.1 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 -37.78 88.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.81 -27.99 63.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.728 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.57 -30.28 69.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.9 t -83.03 -25.55 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.164 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.7 -27.92 61.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.458 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -40.94 58.52 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.5 OUTLIER -76.89 -25.09 52.63 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.032 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -53.74 14.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.639 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -64.75 -26.89 68.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.406 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.26 -59.09 5.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.47 HD12 HG23 ' A' ' 64' ' ' ILE . 28.1 mt -56.42 -25.41 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.231 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.36 75.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.922 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 39.9 mtpt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.738 179.951 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.739 0.304 . . . . 0.0 111.334 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -80.27 -37.69 32.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.504 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -19.74 61.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.348 -179.799 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -48.96 25.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.447 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.21 -29.2 43.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.709 -179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -36.49 77.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.606 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.05 -24.0 38.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.445 0.64 . . . . 0.0 109.768 178.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.37 -25.08 66.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.753 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 27.6 tt0 -77.27 -46.46 23.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -179.626 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -49.6 -27.86 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -76.21 -48.69 19.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.388 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.7 t -70.0 -51.46 39.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.7 mttt -51.0 -31.17 17.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.798 0.333 . . . . 0.0 111.129 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.62 -10.91 47.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.472 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.362 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -27.74 63.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.725 0.298 . . . . 0.0 110.955 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.4 mt -67.63 -29.79 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.711 -179.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -43.65 71.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.93 -179.179 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -70.14 -26.85 64.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.685 0.279 . . . . 0.0 111.432 -179.419 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 72.8 mt -81.06 -21.62 39.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.494 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.74 -59.15 2.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.343 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -52.64 -48.23 66.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.64 -179.539 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.22 -25.2 65.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.736 -179.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.25 -57.87 9.83 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.001 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.87 -55.06 18.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.904 -178.596 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.541 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.7 tt0 -49.33 -28.47 4.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.96 -38.56 82.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.281 -179.658 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -66.48 -58.36 5.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.259 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.426 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 3.1 pttt -51.61 -27.51 11.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.202 -179.871 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.464 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 2.7 tptm -70.8 -25.81 63.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.456 HG21 HD11 ' A' ' 41' ' ' ILE . 8.0 mt -75.71 -42.1 40.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.08 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.26 -30.72 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.608 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 2.9 pt-20 -75.62 -30.66 59.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.095 0.474 . . . . 0.0 110.513 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.431 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.3 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.791 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.604 0.24 . . . . 0.0 111.334 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.3 t -52.5 -25.11 7.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.302 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.55 -28.6 65.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -73.29 -57.18 4.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -55.51 -26.3 19.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.479 -179.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -65.41 -38.05 88.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.99 0.424 . . . . 0.0 110.591 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -72.32 -27.61 62.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.893 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -71.41 -28.9 64.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.493 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.9 t -83.32 -27.7 7.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.283 -179.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -75.61 -28.42 58.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.653 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -76.29 -40.18 52.33 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -178.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.4 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.07 -26.16 48.05 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -71.05 -49.47 44.4 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.934 0.397 . . . . 0.0 110.637 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.72 -26.9 65.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.238 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -62.36 -59.26 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.095 -179.631 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 39.1 mt -51.31 -25.86 4.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -33.99 75.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.818 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.782 0.325 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -76.76 -31.38 57.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.601 -179.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -77.05 -22.34 53.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.731 0.3 . . . . 0.0 111.307 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.28 -55.04 8.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.01 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.4 -29.38 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.508 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.45 -37.18 74.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.718 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.05 -24.26 40.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.613 0.72 . . . . 0.0 109.468 178.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -64.52 -25.2 67.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.815 179.237 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.414 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 47.6 tt0 -77.56 -43.89 30.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.277 -179.417 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -52.94 -29.69 30.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.188 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -76.03 -50.57 14.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.346 -179.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 28.3 t -66.19 -53.1 40.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.509 -179.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.414 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.5 mttt -50.52 -30.51 13.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.353 -179.497 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.06 -11.06 36.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.435 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.106 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.932 0.396 . . . . 0.0 110.906 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.8 mp -55.88 -29.46 26.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.769 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.23 -56.27 24.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.201 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.02 -32.57 69.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 111.091 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 4.5 mt -70.7 -21.13 62.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.555 -179.667 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -78.1 -57.61 3.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.048 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -58.42 6.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.85 0.357 . . . . 0.0 111.789 -179.138 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -25.02 67.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -179.338 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.15 -57.53 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.912 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.507 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.77 -54.12 26.01 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.596 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.507 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.5 tm-20 -47.94 -28.38 2.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.033 0.444 . . . . 0.0 111.204 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.96 -40.58 71.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.3 -179.563 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -61.88 -58.33 8.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.604 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -51.42 -28.04 11.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.386 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.0 -28.66 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.88 -179.955 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.8 mt -75.18 -31.61 24.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.673 179.654 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -69.77 -31.45 69.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.392 179.642 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -75.61 -29.47 59.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.483 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.434 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.6 mt . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.954 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.821 0.343 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.9 p -50.7 -29.55 7.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.53 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -72.06 -29.91 64.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.158 -179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -67.4 -57.25 6.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 -179.821 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 43.6 t -59.61 -25.92 33.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.53 -37.08 85.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.95 0.405 . . . . 0.0 110.472 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.04 -27.87 62.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.719 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.98 -29.01 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.031 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 22.3 t -83.23 -25.69 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.177 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -75.2 -28.34 59.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.506 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -39.44 59.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.646 -179.088 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.426 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -77.25 -24.88 51.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.54 0.21 . . . . 0.0 111.52 -179.566 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -55.01 13.07 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.008 0.432 . . . . 0.0 110.283 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.94 -26.92 68.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.976 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.429 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.8 mt-10 -60.45 -51.33 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.026 -179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 24.4 mt -59.39 -25.68 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -34.68 75.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.833 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.756 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.733 0.301 . . . . 0.0 111.173 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -83.16 -39.71 20.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -19.71 64.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.147 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.67 -55.13 9.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.56 -29.34 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.52 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -36.98 75.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.654 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.75 -23.87 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.566 0.698 . . . . 0.0 109.721 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.411 HD23 ' CD2' ' A' ' 60' ' ' LEU . 4.0 tt -66.61 -25.09 66.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.919 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -79.12 -52.71 7.82 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.438 -179.455 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -47.36 -30.23 3.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.837 0.351 . . . . 0.0 111.329 -179.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.5 tttm -76.19 -36.86 58.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.011 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.9 t -78.21 -54.22 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.35 -179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.53 -29.83 11.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.44 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.35 -12.83 36.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.444 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.945 -179.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -27.7 59.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.888 0.375 . . . . 0.0 111.099 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.2 mt -68.29 -29.6 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -179.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.05 -56.12 17.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.702 -179.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -57.86 -35.95 71.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 0.0 111.223 -179.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 64.9 mt -70.72 -21.32 62.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.691 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -75.28 -59.14 2.88 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -51.97 41.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.196 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 5.1 ttpt -67.55 -24.93 65.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.413 . . . . 0.0 112.084 -179.198 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.91 -57.74 11.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.951 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.66 -54.09 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.055 -178.704 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.515 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 5.9 tt0 -48.25 -28.57 3.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.075 0.464 . . . . 0.0 111.103 -179.826 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.4 tp -69.47 -40.29 77.2 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.186 -179.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -58.13 9.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.358 -179.769 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -54.65 -29.44 52.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.293 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.45 -26.82 68.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.0 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.39 -30.2 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 110.819 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.11 -45.8 83.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.616 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -62.14 -38.87 90.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.378 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.0 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.072 179.939 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.702 0.287 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 16.1 t -54.91 -23.89 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.341 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -72.36 -34.96 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.012 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -66.6 -57.32 7.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -57.55 -25.95 25.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.342 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -66.0 -37.74 86.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.921 0.391 . . . . 0.0 110.62 179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.37 -27.89 62.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.859 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -71.07 -28.89 64.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.32 -25.98 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.037 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -75.46 -28.61 59.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.795 -179.49 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -39.96 63.05 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -178.91 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.442 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.38 -26.21 46.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.228 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -40.35 70.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.969 0.414 . . . . 0.0 110.892 -179.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -76.48 -26.83 55.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.227 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -59.28 4.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.153 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.482 HD11 HG22 ' A' ' 64' ' ' ILE . 38.7 mt -51.97 -27.95 9.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -62.17 -33.15 73.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.858 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.832 0.348 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -71.32 -33.89 70.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.21 -19.53 56.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.509 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.58 -39.07 32.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.814 -179.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.1 t -79.16 -29.55 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.121 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -65.51 -34.68 78.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.054 0.454 . . . . 0.0 110.087 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.63 -25.07 35.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.606 178.463 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.446 HD23 ' CD2' ' A' ' 60' ' ' LEU . 3.7 tt -66.55 -25.6 66.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.863 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -76.77 -46.33 25.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.018 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -51.75 -27.05 10.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.02 -43.85 42.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.069 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.3 t -76.78 -57.45 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.258 -179.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -53.06 -23.83 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.236 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -18.14 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.125 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.941 179.875 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.582 -0.207 . . . . 0.0 112.582 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -27.65 54.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.322 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.08 -29.64 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.479 -179.63 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -64.15 -56.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.697 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.13 -28.02 67.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.693 0.282 . . . . 0.0 111.328 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 88.5 mt -76.5 -21.62 55.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.639 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -78.22 -59.52 2.74 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.42 -36.96 46.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.829 -179.258 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.6 ttpt -82.19 -24.81 34.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.141 -179.152 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.12 -57.88 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.479 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -42.46 79.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.564 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.85 -28.2 67.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.096 0.474 . . . . 0.0 110.918 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 tp -69.04 -44.74 72.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.554 -179.29 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -59.88 -58.25 9.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.777 0.322 . . . . 0.0 111.544 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -54.31 -27.81 38.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.22 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.413 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 1.7 tptp -67.63 -25.98 66.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.057 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.416 HG22 HD12 ' A' ' 41' ' ' ILE . 7.2 mt -77.1 -34.01 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.86 0.362 . . . . 0.0 110.48 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.6 -30.81 71.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.385 179.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.8 pt-20 -78.01 -29.45 49.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.477 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.438 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 14.6 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 CA--C 1.528 0.122 0 CA-C-O 120.673 0.273 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.29 -19.7 24.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.445 179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -76.94 -26.48 54.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.331 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -57.14 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 0.0 110.591 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.3 t -54.04 -31.98 22.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.282 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -59.17 -38.99 81.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.983 0.42 . . . . 0.0 110.616 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -71.88 -27.69 63.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.743 179.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -67.1 -28.62 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.38 -25.6 8.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.037 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.19 60.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.466 -179.619 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.19 -40.48 52.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -178.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.446 ' CD2' HD23 ' A' ' 14' ' ' LEU . 1.1 tt -77.0 -24.83 52.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.23 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.69 -54.63 11.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.02 0.438 . . . . 0.0 110.483 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -63.61 -26.96 68.92 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.961 179.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.403 ' CG ' HD23 ' A' ' 30' ' ' LEU . 1.9 tm-20 -61.27 -58.71 7.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.048 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.415 HG23 HD13 ' A' ' 64' ' ' ILE . 32.1 mt -54.08 -27.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.197 179.843 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -32.9 74.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.701 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 tt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.782 0.325 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.02 -33.7 68.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.263 -179.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.25 -19.94 55.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.473 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -45.52 65.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.46 -179.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.38 -29.18 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 -179.394 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -35.6 81.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.141 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -26.59 35.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.476 0.655 . . . . 0.0 109.62 178.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.402 HD21 ' CD2' ' A' ' 60' ' ' LEU . 4.0 tt -64.38 -25.39 68.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.913 179.557 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.86 -45.51 24.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.0 -26.82 11.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -48.6 19.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.425 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 3.3 t -70.9 -56.04 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.58 -20.49 8.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.05 -16.01 27.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.633 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.5 pp . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.764 0.316 . . . . 0.0 111.002 -179.86 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -27.84 26.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.7 mt -68.79 -29.64 44.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.442 -179.485 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.91 -56.07 17.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.527 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -55.95 -26.9 50.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 -179.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.453 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 56.1 mt -81.09 -21.14 40.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.785 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -74.43 -54.42 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.722 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -54.55 -52.11 63.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.752 0.311 . . . . 0.0 111.761 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.465 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.9 ttpp -66.69 -25.08 66.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.924 -179.408 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.75 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.067 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.553 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.99 -56.16 11.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.127 -178.593 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.553 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 20.3 tt0 -47.85 -28.5 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 111.348 -179.688 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.2 tp -68.99 -38.68 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.472 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -66.38 -58.26 5.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.399 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -52.19 -28.02 16.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.449 -179.629 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -69.34 -25.91 64.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mt -77.8 -34.91 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 110.734 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.93 -29.67 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 179.719 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -78.5 -30.89 47.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 110.575 179.734 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.491 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 8.5 mt . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.869 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 . . . . . 0 N--CA 1.457 -0.09 0 CA-C-O 120.781 0.324 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.05 -30.17 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.281 -179.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -67.64 -38.57 84.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -60.18 -57.19 13.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.993 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.78 -25.87 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.72 -38.53 89.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.883 0.373 . . . . 0.0 110.592 179.853 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.36 -27.86 63.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.804 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.62 -28.9 65.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.06 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 23.0 t -83.12 -25.82 7.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.42 -28.49 59.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.668 -179.538 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.84 -40.52 63.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.875 -178.992 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.465 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.18 -25.83 47.36 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.238 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -71.79 -40.05 69.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.945 0.403 . . . . 0.0 110.794 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.38 -26.88 56.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.272 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -63.87 -59.11 4.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -179.68 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 35.3 mt -51.87 -26.48 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.236 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -31.65 69.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.766 179.895 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.803 0.335 . . . . 0.0 111.153 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.47 -31.84 58.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.536 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.29 -23.92 51.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.552 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -55.2 14.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 111.338 -179.393 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.7 t -70.03 -28.96 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.519 -179.608 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.0 -36.14 78.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.463 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.33 -24.42 39.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.513 0.673 . . . . 0.0 109.445 178.67 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -25.22 66.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.938 179.361 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.428 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.4 tt0 -70.7 -47.04 61.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.24 -179.373 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -50.05 -26.58 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.216 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -76.1 -43.74 41.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.536 -179.775 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.405 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 2.7 t -78.13 -43.48 27.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.409 -179.498 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.7 mtpt -49.79 -36.52 26.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.028 0.442 . . . . 0.0 110.737 179.777 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.47 -10.95 35.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.795 179.294 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 4.8 tp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.105 -179.56 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -27.89 64.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.845 0.355 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mt -73.37 -29.83 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.13 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -65.68 -56.18 13.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.586 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.03 -36.03 74.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.865 0.364 . . . . 0.0 111.281 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' A' ' 60' ' ' LEU . 96.6 mt -70.7 -21.62 62.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.833 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.47 -57.25 4.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -54.83 -42.33 71.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.217 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.45 60.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.638 -179.502 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.12 -57.81 10.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.938 0.399 . . . . 0.0 111.913 -179.167 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.37 -53.22 38.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.929 -178.801 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.505 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.2 tt0 -49.21 -28.55 4.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 111.176 -179.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 tp -71.44 -38.79 71.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.501 -179.522 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -58.34 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.73 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.43 -28.13 12.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.476 -179.512 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -28.66 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.974 -179.876 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.452 HD13 HG21 ' A' ' 41' ' ' ILE . 7.2 mt -75.77 -31.92 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.896 0.379 . . . . 0.0 110.506 179.707 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -68.1 -31.88 71.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.385 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -75.8 -29.75 58.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.421 179.496 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 14.1 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.527 0.066 0 CA-C-O 120.706 0.288 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -54.2 -24.1 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -66.74 -36.75 83.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -70.65 -57.11 5.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.878 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.6 t -50.24 -26.34 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.465 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.2 -32.67 74.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -27.95 47.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.725 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -68.66 -28.87 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 t -83.14 -25.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.811 179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -74.04 -28.1 61.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.51 -179.609 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -39.41 63.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.041 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.0 -25.75 48.18 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.165 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -46.59 64.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.949 0.404 . . . . 0.0 110.88 -179.86 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -71.79 -26.98 62.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.416 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -62.71 -59.18 5.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.031 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.437 HD12 HG21 ' A' ' 64' ' ' ILE . 38.1 mt -51.22 -28.13 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.289 179.957 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -29.76 68.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 -179.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.5 mttm . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.097 -179.905 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.805 0.336 . . . . 0.0 111.062 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -74.3 -33.23 63.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.137 -179.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.19 -20.11 55.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.357 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.77 -43.13 38.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.333 -179.559 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.62 -29.06 22.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.706 -179.568 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -36.43 81.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.018 0.437 . . . . 0.0 110.352 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -23.85 37.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.548 0.689 . . . . 0.0 109.514 178.518 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -25.06 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.054 179.527 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -76.33 -50.63 13.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.309 -179.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -51.7 -26.18 8.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.783 0.325 . . . . 0.0 111.074 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -41.55 49.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 11.7 t -78.14 -51.81 17.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.19 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.5 -31.6 10.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.464 -179.649 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.96 -10.84 37.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.52 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.823 0.344 . . . . 0.0 110.987 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -37.53 77.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.897 0.38 . . . . 0.0 110.932 179.833 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.0 mt -71.19 -29.5 36.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.526 -179.74 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -62.25 -56.21 20.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.7 -179.363 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.1 -51.29 70.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.959 0.409 . . . . 0.0 111.466 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.42 ' HA ' HD13 ' A' ' 60' ' ' LEU . 96.1 mt -58.4 -21.09 49.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.122 -179.128 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -74.09 -59.04 2.91 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -178.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -45.41 62.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.927 -179.234 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.23 -24.93 61.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.024 -179.167 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.16 -57.86 9.13 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.694 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.21 81.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.936 -178.644 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -28.03 60.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.105 0.479 . . . . 0.0 110.889 179.997 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 tp -71.34 -41.7 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.287 -179.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.6 mttm -58.64 -58.3 9.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.675 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -51.64 -27.77 12.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.685 -179.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 tttp -73.61 -25.8 60.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.459 -179.562 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.27 -39.11 34.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 111.239 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -63.92 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 179.666 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.499 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.46 -30.94 60.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.485 179.609 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.499 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 11.7 mt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.988 179.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.799 0.333 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -51.9 -30.27 12.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.373 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -29.12 65.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.082 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -68.87 -57.24 5.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.984 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.12 -26.91 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.084 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.34 -36.1 83.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -73.89 -27.92 61.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.768 179.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.44 -29.0 66.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.5 t -83.24 -25.71 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.066 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -75.11 -28.26 60.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -39.93 61.76 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.132 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -78.17 -25.73 47.36 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -178.996 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -49.45 47.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.002 0.429 . . . . 0.0 110.644 -179.834 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.06 -26.68 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.099 179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -56.33 20.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 -179.632 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 25.7 mt -57.03 -25.87 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.264 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -62.58 -31.24 72.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.878 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.6 mttp . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.926 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.122 0 CA-C-O 120.685 0.279 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.0 mt-10 -79.63 -39.91 30.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.276 -179.711 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -19.78 63.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.106 -179.946 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -46.75 67.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.069 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.3 t -71.89 -29.06 32.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.604 -179.711 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 -36.64 80.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.563 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.33 -24.53 37.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.589 0.709 . . . . 0.0 109.712 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.421 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.8 tt -65.9 -25.07 66.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.965 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.444 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -75.67 -41.05 54.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.388 -179.273 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -54.98 -28.12 49.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.307 -179.856 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -48.42 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.487 -179.688 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.7 t -69.71 -47.77 68.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.491 -179.395 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 4.3 mtpm? -51.43 -28.76 13.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.232 -179.71 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.11 -10.95 37.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 -179.76 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.416 -0.274 . . . . 0.0 112.416 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -62.11 1.95 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 110.942 179.872 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.2 mt -60.48 -29.76 45.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.524 -179.76 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -56.14 26.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.772 0.32 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.83 -30.83 67.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.974 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' CD2' ' HB3' ' A' ' 63' ' ' GLU . 3.4 mt -70.57 -21.8 62.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.385 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -78.6 -59.32 2.83 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -53.05 -36.72 60.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.776 0.322 . . . . 0.0 111.828 -179.041 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -82.04 -24.99 35.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.991 -179.321 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.68 -57.81 8.86 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.532 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -42.29 84.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.528 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.89 -28.16 65.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.013 0.435 . . . . 0.0 110.995 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tp -70.41 -47.0 62.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.52 -179.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -58.17 9.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 111.411 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -27.92 13.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.441 -179.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.3 tttp -69.87 -29.6 66.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.036 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.5 mt -75.11 -31.79 25.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.756 179.774 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -31.44 69.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.494 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.89 -29.9 58.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.574 179.667 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.48 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 7.4 mt . . . . . 0 C--N 1.326 -0.432 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.894 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.4 t -55.63 -23.2 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.415 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.2 tttt -72.9 -32.47 65.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.943 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -65.93 -57.17 8.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.837 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.8 -28.05 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 179.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.67 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.945 0.402 . . . . 0.0 110.617 179.812 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -68.67 -27.86 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.784 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -70.26 -28.76 65.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.028 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.2 t -82.11 -25.81 9.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -75.18 -28.64 60.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.259 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -37.48 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.613 -179.229 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 4.2 tt -76.59 -27.69 55.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.405 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -56.18 11.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.051 0.453 . . . . 0.0 110.49 179.868 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -62.65 -26.87 68.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.821 179.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.503 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.91 -44.54 97.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.956 -179.92 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.4 ' CG1' HD23 ' A' ' 30' ' ' LEU . 13.9 mt -67.35 -24.26 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 110.885 179.505 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -33.87 76.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.769 179.925 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.732 0.301 . . . . 0.0 111.239 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -77.2 -33.62 56.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.405 -179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.22 -24.58 59.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.104 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -70.42 -52.0 25.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.1 t -63.65 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -38.21 70.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.55 -28.85 46.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.544 0.688 . . . . 0.0 109.485 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.433 HD21 ' CD2' ' A' ' 60' ' ' LEU . 3.8 tt -59.75 -25.22 64.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.812 179.121 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.425 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.6 tt0 -77.73 -43.52 30.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.305 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -52.28 -30.98 30.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.179 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -76.06 -37.23 58.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.294 -179.835 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.2 t -78.1 -53.46 14.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.626 -179.594 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -49.77 -30.11 8.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.499 -179.468 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.8 -12.88 37.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.436 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.014 -179.984 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -27.58 64.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 111.062 -179.981 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mt -70.74 -29.56 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.499 -179.597 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.07 -56.27 16.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.815 -179.156 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.73 -38.66 82.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.4 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 80.0 mt -67.78 -21.37 65.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.841 -179.369 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.08 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.59 -43.16 65.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 0.0 111.778 -179.279 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.403 ' CE ' HD13 ' A' ' 60' ' ' LEU . 7.1 ttpt -74.73 -24.95 58.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.908 -179.288 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -57.98 8.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.746 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.81 -51.33 34.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.814 -178.709 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.475 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.7 tt0 -50.86 -28.24 9.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.884 179.904 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.6 tp -70.26 -41.81 72.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.424 -179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.07 -58.23 9.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.647 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -52.97 -27.77 20.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.347 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 3.7 tppp? -70.46 -25.67 63.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.71 -36.95 27.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 0.0 111.083 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -67.95 -29.63 68.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.764 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -77.66 -29.95 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.15 0.5 . . . . 0.0 110.551 179.552 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.457 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.2 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.152 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.1 -20.26 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.469 -179.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -32.16 64.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.215 -179.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.2 ttpp -67.95 -57.3 6.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 51.4 t -58.99 -25.98 31.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.044 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -37.99 88.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.504 179.798 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -71.31 -28.77 64.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.684 179.722 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.66 -28.89 66.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.7 t -83.06 -25.69 8.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.013 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -28.36 60.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.568 -179.606 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -38.73 58.11 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.078 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.433 ' CD2' HD21 ' A' ' 14' ' ' LEU . 1.0 OUTLIER -77.58 -25.55 50.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.256 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.13 -54.99 10.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.01 0.433 . . . . 0.0 110.509 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.8 -26.92 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.403 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.45 -59.11 5.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.17 -179.666 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.416 HG21 HD11 ' A' ' 64' ' ' ILE . 36.6 mt -52.73 -27.45 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.387 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -64.75 -29.87 70.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.916 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.1 mttm . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.017 -179.925 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.718 0.294 . . . . 0.0 111.307 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -78.67 -38.34 39.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.458 -179.452 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -19.86 62.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.534 -179.633 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -73.06 -53.7 10.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 -179.734 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.89 -29.31 46.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.72 -179.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -58.57 -37.06 74.95 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.727 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.22 -23.91 40.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.582 0.706 . . . . 0.0 109.463 178.73 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.408 HD21 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.23 -25.22 67.59 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.946 179.36 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.407 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -74.24 -42.1 60.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.117 -179.38 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -56.81 -26.02 57.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.176 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -51.88 11.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.432 -179.768 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 8.5 t -68.12 -47.79 76.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.446 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.5 mtpt -50.81 -27.16 6.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.327 -179.704 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.13 -10.86 37.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.533 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.667 -179.832 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.461 -0.256 . . . . 0.0 112.461 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -27.64 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.814 0.34 . . . . 0.0 111.023 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.8 mt -68.55 -29.67 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.459 -179.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.96 -56.15 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.64 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.18 -30.43 70.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 111.281 -179.497 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 95.0 mt -73.6 -21.35 60.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.491 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -78.06 -59.4 2.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.728 -179.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -33.59 59.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.793 0.33 . . . . 0.0 111.566 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.96 -24.89 35.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.813 -179.521 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -65.71 -58.05 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.766 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.9 -41.94 74.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.878 -178.832 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.5 -28.27 66.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.037 0.446 . . . . 0.0 110.789 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 tp -70.26 -40.75 74.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.461 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -61.72 -58.32 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.599 -179.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -50.59 -28.27 8.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.559 -179.601 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -69.79 -28.42 65.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.87 -179.995 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.3 mt -76.2 -30.26 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.586 179.579 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.89 -33.34 73.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.244 179.468 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -74.5 -30.61 61.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.342 179.61 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.48 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 13.3 mt . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.843 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.634 0.254 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.32 -18.85 12.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.625 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -74.65 -29.88 61.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.201 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -78.0 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.089 -179.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.23 -25.86 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.29 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.8 -35.17 79.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.392 . . . . 0.0 110.55 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -75.18 -27.67 59.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.739 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -69.29 -30.77 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.115 -179.827 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.6 t -83.3 -25.57 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.183 -179.958 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.98 -27.97 60.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.579 -179.524 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -76.06 -39.54 55.23 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -178.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -77.97 -25.26 48.03 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.273 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -52.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.05 0.452 . . . . 0.0 110.715 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -66.5 -26.92 67.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.225 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.4 tm-20 -61.89 -56.12 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 30.0 mt -56.15 -26.8 22.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.045 179.915 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -34.22 75.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.81 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.7 mmtt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.606 179.854 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.792 0.33 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -73.87 -32.99 63.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.17 -20.21 55.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.341 -179.84 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -51.13 48.05 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.894 0.378 . . . . 0.0 111.101 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 24.4 t -72.7 -29.19 29.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.44 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -61.44 -36.57 80.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.406 179.985 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.26 -24.01 37.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.499 0.666 . . . . 0.0 109.56 178.623 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.01 -25.21 66.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.883 179.403 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.36 -47.78 26.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.221 -179.585 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -50.25 -28.23 7.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.157 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -76.11 -41.71 49.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.342 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.5 t -75.46 -55.08 12.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.422 -179.705 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -50.82 -29.33 11.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.357 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.08 -11.68 35.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.4 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.928 -179.965 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -27.82 47.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 0.0 111.102 -179.913 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 71.4 mt -76.25 -29.58 19.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.291 -179.604 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -68.39 -45.76 71.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.184 -179.752 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -69.19 -29.35 67.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.389 . . . . 0.0 110.818 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 24.1 mt -74.53 -21.89 59.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.293 -179.841 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.65 -59.34 2.82 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.878 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -50.42 -56.85 9.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.647 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.406 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.1 OUTLIER -63.8 -24.99 67.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.18 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.44 -57.62 11.46 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.659 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.511 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.2 OUTLIER -68.96 -54.49 15.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.588 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.511 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.3 tt0 -47.78 -28.75 2.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.031 0.443 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 tp -69.81 -38.37 76.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.197 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -63.62 -58.2 7.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -50.66 -27.95 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.29 -179.854 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -70.56 -28.43 64.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.862 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.0 mt -74.07 -31.94 31.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.99 0.424 . . . . 0.0 110.58 179.614 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -67.86 -35.83 79.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.327 179.516 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -71.59 -29.37 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 179.568 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.457 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 13.1 mt . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.921 -179.984 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 25.1 t -54.89 -24.02 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.387 179.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -71.17 -29.44 65.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.013 -179.985 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.8 tptt -71.17 -57.26 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.89 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.0 t -55.49 -27.66 21.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.97 -31.84 73.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 110.649 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -79.55 -27.77 41.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -68.87 -28.73 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.319 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.9 t -83.1 -25.52 8.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.113 -179.892 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.15 -28.53 60.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.442 -179.66 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -40.46 52.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.742 -179.149 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.448 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 1.7 tt -76.2 -25.1 54.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.589 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -55.96 9.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.21 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.52 -26.79 68.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.464 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -60.59 -50.01 75.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.992 -179.919 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 60' ' ' LEU . 14.2 mt -68.19 -22.79 27.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.784 179.452 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -38.74 67.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.383 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 mttp . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 120.977 0.418 . . . . 0.0 110.733 -179.979 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -78.05 -33.48 50.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.556 -179.397 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -19.8 56.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.77 0.319 . . . . 0.0 111.67 -179.743 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -47.38 23.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.796 -179.166 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.6 t -74.79 -29.12 22.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.907 -179.264 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 ttpp -63.25 -36.25 83.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.324 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.52 -23.86 37.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.57 0.7 . . . . 0.0 109.753 178.722 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.4 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.6 tt -68.07 -25.12 65.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.211 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -75.0 -51.88 12.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.495 -179.4 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -50.2 -26.98 5.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.322 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -43.87 41.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.21 179.976 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.3 t -76.12 -48.12 29.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.556 -179.717 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.59 -31.7 11.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.518 -179.552 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.13 -11.04 39.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.505 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.99 -179.869 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 N-CA-C 112.573 -0.211 . . . . 0.0 112.573 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -53.22 60.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.901 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.4 mt -60.21 -29.48 44.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.628 -179.473 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -59.09 -56.22 24.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.651 -179.265 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -58.45 -36.89 74.37 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.923 0.392 . . . . 0.0 111.225 -179.574 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 6.5 mt -66.77 -21.79 66.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.887 -179.387 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 tttm -78.63 -59.54 2.74 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.831 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -37.41 56.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -178.921 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -82.25 -24.67 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.204 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.84 -57.81 7.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.494 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -40.85 77.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.67 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.5 tt0 -59.74 -27.78 66.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.13 0.49 . . . . 0.0 110.659 179.869 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.81 -40.02 55.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.66 -179.234 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.81 -33.23 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.842 -179.311 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 4.2 ptmt -79.05 -30.45 44.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.058 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -63.28 -26.0 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.893 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.422 HG22 HD13 ' A' ' 41' ' ' ILE . 9.3 mt -73.55 -30.08 28.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.622 179.685 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.7 -35.63 75.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.435 179.519 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -71.71 -28.8 63.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.479 179.603 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.441 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.3 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.988 179.985 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.16 -30.04 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.308 -179.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -33.46 74.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.061 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -57.29 12.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.864 -179.837 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 39.7 t -55.11 -26.08 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.109 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.78 -34.35 77.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.025 0.441 . . . . 0.0 110.373 179.588 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -76.3 -28.16 56.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.469 179.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.23 -28.76 68.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.881 179.826 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.5 t -81.81 -25.42 9.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.898 179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.7 -28.47 61.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.263 -179.852 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -74.51 -38.69 62.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.738 -179.373 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.452 ' O ' HG13 ' A' ' 64' ' ' ILE . 3.0 tt -76.58 -26.01 54.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.343 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.36 -56.26 9.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.01 0.433 . . . . 0.0 110.289 179.82 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -61.85 -26.64 68.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.36 179.242 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.413 ' CB ' ' CD2' ' A' ' 30' ' ' LEU . 3.2 mm-40 -61.16 -45.0 96.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 60' ' ' LEU . 14.8 mt -68.48 -23.76 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.023 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -34.34 76.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mtpm? . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.6 179.838 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -149.3 -47.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.8 -72.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.97 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.19 -42.76 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.331 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -57.67 -30.49 65.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.047 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.473 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -83.18 -25.75 31.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.335 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.94 -46.99 86.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.627 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.01 -32.84 73.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.961 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 2.5 pt-20 -77.44 -19.96 55.25 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -50.14 19.09 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.8 t -74.83 -29.26 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -36.57 81.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -24.22 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.535 0.683 . . . . 0.0 109.547 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.426 HD23 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.94 -25.11 66.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.954 179.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.413 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.9 tt0 -77.67 -44.46 27.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.168 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -52.31 -27.28 14.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -53.19 8.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.225 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.628 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.3 t -64.8 -52.03 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.312 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 12.1 mttt -52.23 -25.65 9.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.448 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.61 -11.04 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.84 -156.59 0.1 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.526 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 178.86 148.96 7.92 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.542 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.04 160.96 23.64 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.539 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 -169.79 34.62 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.466 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.25 -111.43 4.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.533 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -27.75 65.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.776 0.322 . . . . 0.0 111.034 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.1 mt -72.73 -29.53 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.442 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -56.17 12.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.804 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.61 -35.98 77.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 111.483 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 83.6 mt -71.1 -21.48 62.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.944 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -76.37 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 mttm -54.04 -43.04 69.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.352 . . . . 0.0 111.496 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.429 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -72.54 -25.11 61.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.695 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.85 -57.77 8.83 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.805 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.447 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.18 -49.15 62.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.447 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.9 pt-20 -54.32 -28.55 43.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 0.0 110.989 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.1 tp -67.72 -41.98 82.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.064 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -58.21 9.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.287 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptpm? -51.11 -28.02 9.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.318 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -70.91 -25.9 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.419 HD12 HG22 ' A' ' 41' ' ' ILE . 6.8 mt -77.84 -30.54 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.824 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -67.45 -41.03 85.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.588 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.405 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.9 pt-20 -66.84 -35.42 80.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.513 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.405 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 10.9 mt -55.31 170.56 0.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.113 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -117.81 -112.06 2.57 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.424 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.7 -45.18 1.06 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.495 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -147.59 -175.2 20.17 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.494 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.25 -99.99 2.47 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.489 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -62.95 -18.01 62.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.703 0.287 . . . . 0.0 111.205 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 18.3 t -55.37 -22.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.504 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -72.33 -36.08 68.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.097 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -64.83 -57.41 8.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.961 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.401 ' CG2' ' CD1' ' A' ' 44' ' ' LEU . 28.0 t -57.96 -26.28 28.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.27 -37.32 87.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 110.414 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -71.85 -28.18 63.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.577 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -68.78 -29.46 67.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.872 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.7 t -83.25 -25.55 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.026 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -73.83 -28.26 61.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.522 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -75.37 -44.0 47.34 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.426 ' CD2' HD23 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -74.02 -25.12 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.01 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -70.43 -55.3 9.36 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.055 0.455 . . . . 0.0 110.752 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -62.22 -26.81 68.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.214 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -56.74 14.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.413 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.402 HG23 HD13 ' A' ' 64' ' ' ILE . 21.5 mt -58.19 -24.57 24.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.345 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -31.76 58.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.515 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -106.99 -68.1 0.91 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 111.364 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 97.5 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.95 -179.809 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.628 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.529 -0.228 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m -135.98 159.0 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.865 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -176.49 -39.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.963 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -79.78 -28.63 12.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.239 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -68.39 -29.54 68.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.93 0.395 . . . . 0.0 110.724 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.12 -25.47 31.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -49.55 66.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.536 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -61.51 -34.83 76.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.884 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.1 -19.57 56.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.722 0.296 . . . . 0.0 111.604 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.8 -44.51 63.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.671 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.3 t -79.1 -29.05 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.913 -179.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -36.53 83.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.248 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.68 -26.66 34.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.545 0.688 . . . . 0.0 109.565 178.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.407 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.0 OUTLIER -64.28 -25.15 67.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.09 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -76.85 -56.06 4.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.341 -179.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.07 -27.91 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.491 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -76.03 -41.62 50.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.345 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.636 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 22.1 t -76.13 -48.59 27.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.523 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -49.16 -32.89 11.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.348 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -11.0 43.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.591 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.44 164.71 13.31 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -139.77 120.6 1.86 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.513 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 147.85 -176.13 26.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.555 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.89 -179.34 16.53 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.484 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.41 -91.2 0.74 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.471 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -60.28 3.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.906 0.384 . . . . 0.0 111.05 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.1 mt -55.0 -29.64 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.501 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -56.26 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.293 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.39 -28.95 63.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.9 0.381 . . . . 0.0 110.957 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.508 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 3.2 mt -74.54 -21.56 59.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.539 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.11 -59.2 2.88 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.05 -42.39 49.68 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.4 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -80.88 -25.21 37.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.901 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.19 -57.57 12.23 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.539 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.83 -55.73 15.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.459 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.539 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.4 tt0 -47.94 -28.39 2.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.039 0.447 . . . . 0.0 111.246 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.411 ' CD2' ' CG2' ' A' ' 57' ' ' VAL . 12.1 tp -71.41 -38.29 71.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.454 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.81 -58.28 6.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.536 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -27.8 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.348 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 1.8 tptt -70.38 -25.58 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.239 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.63 -37.26 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.839 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.25 -29.71 69.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.779 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 4.4 pt-20 -78.4 -30.51 47.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.559 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.4 mt -59.61 162.63 4.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.037 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -105.81 -46.8 1.16 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 135.84 69.29 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.596 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 133.21 145.81 5.45 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.536 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.37 -64.56 4.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.562 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -95.07 -22.84 17.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.755 0.312 . . . . 0.0 110.986 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.9 p -52.85 -29.39 14.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.427 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.85 87.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.082 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -60.03 -57.09 14.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.066 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 24.4 t -55.79 -25.87 19.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.24 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.84 -37.84 87.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.35 . . . . 0.0 110.556 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.07 -27.98 63.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.795 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -70.61 -28.89 65.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.411 ' CG2' ' CD2' ' A' ' 37' ' ' LEU . 20.8 t -83.25 -25.56 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.054 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -28.64 60.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.4 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -39.67 54.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 3.5 tt -75.14 -25.25 58.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.481 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -56.1 8.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.951 0.405 . . . . 0.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.93 -26.96 67.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.494 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 2.2 mt-10 -61.66 -46.76 88.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 60' ' ' LEU . 17.2 mt -65.26 -24.2 34.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.01 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.31 -31.77 72.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.911 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -64.42 -61.12 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.087 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.636 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.241 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -85.57 -177.99 6.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -172.12 -42.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.866 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.78 -28.16 40.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.237 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 pttm -58.74 -34.97 71.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.87 -25.57 53.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.104 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.11 -28.84 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.117 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -81.93 -43.35 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.364 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -66.41 -19.87 65.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.423 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.67 -53.98 9.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.302 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 36.8 t -60.56 -29.23 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.723 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -37.23 74.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.8 40.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.47 0.653 . . . . 0.0 109.522 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.412 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.3 tt -65.51 -25.12 67.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.915 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.409 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.4 tt0 -75.28 -46.43 33.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.098 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.22 -27.71 23.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -41.31 50.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.088 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.655 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 25.3 t -78.14 -51.78 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.579 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -49.82 -31.1 11.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.49 -179.559 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -11.59 38.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.464 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -65.11 -69.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.997 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 76.77 142.39 1.38 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.448 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.0 -165.09 24.39 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.528 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.35 144.86 15.06 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.513 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.01 -93.32 0.77 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.611 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -55.47 20.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.041 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.6 mp -58.5 -29.67 39.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.717 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -56.21 21.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 0.0 111.299 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -26.82 64.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.191 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.505 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 5.6 mt -76.66 -21.68 55.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -78.56 -59.35 2.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -39.21 58.32 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -81.9 -24.96 35.39 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.07 -57.71 10.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.668 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.86 -46.45 71.69 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.576 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.411 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 6.0 tt0 -53.83 -28.17 34.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 0.0 110.835 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.7 tp -72.03 -41.78 67.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.388 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -58.18 9.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.538 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt -52.96 -28.54 24.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.351 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.15 -29.89 68.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.103 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -74.47 -31.76 28.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.872 0.368 . . . . 0.0 110.671 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -68.83 -31.95 71.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.534 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -75.26 -29.65 60.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.446 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 6.1 mt -59.95 170.84 1.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.969 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.87 -72.86 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.548 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 175.16 42.0 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.544 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.35 -124.39 5.29 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.501 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -108.47 -29.43 4.2 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.406 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.86 -18.94 61.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.63 0.252 . . . . 0.0 111.117 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.2 t -51.53 -28.04 8.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.796 0.332 . . . . 0.0 111.454 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.74 -29.46 62.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.979 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -63.28 -57.17 11.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.5 t -61.12 -29.72 46.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.16 -179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -63.21 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.703 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -79.06 -27.67 43.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.895 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -69.27 -28.54 66.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.379 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 7.2 t -83.22 -25.87 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.116 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -75.23 -28.61 59.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -37.85 56.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.676 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.433 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 3.6 tt -76.93 -25.78 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.118 -0.233 . . . . 0.0 111.439 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.36 -56.08 9.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.988 0.423 . . . . 0.0 110.28 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -62.25 -26.78 68.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.776 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.451 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -60.27 -47.57 85.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.019 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 15.4 mt -66.37 -24.01 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.111 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -63.13 -33.99 76.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -65.35 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.717 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.404 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 3.3 pp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.085 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.655 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.6 m -69.28 101.97 1.62 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.867 0.365 . . . . 0.0 110.849 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.65 -43.66 2.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.882 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.46 -38.5 46.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.143 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tmtm? -57.47 -28.44 63.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.71 -25.09 44.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.186 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.79 -33.53 68.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.496 -179.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -83.06 -32.82 26.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.737 0.303 . . . . 0.0 111.404 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 pp20? -76.2 -19.16 58.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.199 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.87 -46.97 14.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.009 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.9 t -72.51 -29.51 31.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -63.11 -35.42 80.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.934 0.397 . . . . 0.0 110.358 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.5 -23.76 37.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.496 0.665 . . . . 0.0 109.572 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.4 tt -67.4 -25.22 65.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.004 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.407 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 26.9 tt0 -77.2 -48.47 17.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.247 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.38 -25.88 10.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.188 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -76.06 -45.2 35.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.58 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.3 t -75.77 -51.04 21.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.458 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.3 mttt -52.2 -30.43 27.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.26 -179.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.0 -11.45 35.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.287 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.34 -70.06 0.36 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.028 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.13 -102.61 0.34 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.508 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 159.26 122.2 0.65 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.518 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -164.74 28.67 0.21 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.798 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.56 -103.48 0.48 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.836 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -27.91 11.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 111.289 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 59.9 mt -64.59 -29.82 48.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.167 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -59.75 -56.02 26.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.338 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.42 -36.72 71.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 0.0 111.282 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 7.1 mt -67.1 -21.86 65.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.643 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -78.54 -59.1 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -51.89 -59.09 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.816 0.341 . . . . 0.0 111.914 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.43 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -59.92 -24.99 64.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.698 -179.458 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.03 -57.75 11.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.536 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -67.25 -55.47 13.86 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.561 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.536 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.8 OUTLIER -47.98 -28.27 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 0.0 111.18 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.401 ' CD2' ' CG2' ' A' ' 57' ' ' VAL . 10.8 tp -70.51 -41.33 72.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.342 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -58.27 9.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.548 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -52.46 -27.98 18.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.242 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.07 -25.82 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.053 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.7 mt -74.07 -31.85 31.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.862 0.363 . . . . 0.0 110.67 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -67.95 -33.56 74.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.335 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -74.66 -28.59 60.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.737 179.612 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.449 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 7.8 mt -58.66 173.23 0.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.108 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -129.72 -81.96 0.28 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.558 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -151.79 -43.73 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.523 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -144.29 149.14 21.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.597 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.1 -74.06 0.26 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.524 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -95.03 -23.3 17.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.728 0.299 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 p -49.46 -27.19 2.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.691 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -26.06 61.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.414 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -77.96 -57.39 3.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.206 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.3 t -57.5 -25.89 25.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.325 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -38.03 86.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 110.652 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.03 -27.79 62.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -72.06 -28.7 63.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.438 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.401 ' CG2' ' CD2' ' A' ' 37' ' ' LEU . 16.9 t -83.23 -27.35 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.224 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -28.71 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.76 -39.08 52.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.939 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.45 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.5 OUTLIER -78.14 -24.94 47.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.43 -54.27 13.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.985 0.422 . . . . 0.0 110.205 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -64.03 -26.85 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.635 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 8.6 mm-40 -59.37 -57.7 11.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.468 HD11 HG23 ' A' ' 64' ' ' ILE . 29.6 mt -56.14 -25.6 20.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.24 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -28.09 65.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.82 -37.45 70.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.017 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.58 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.75 -30.83 6.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.771 0.319 . . . . 0.0 110.983 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -59.88 -64.55 0.91 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -72.78 -42.32 61.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.347 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -31.64 63.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.937 0.399 . . . . 0.0 110.963 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.17 -25.77 31.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.253 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.24 -34.71 78.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 -179.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -68.08 -34.14 75.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.295 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -77.06 -19.79 56.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.409 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -42.74 67.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.346 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.1 t -78.4 -29.31 14.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.6 81.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.043 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.9 37.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.539 0.685 . . . . 0.0 109.59 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.99 -25.33 66.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.905 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.13 -50.7 11.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.091 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -49.42 -27.46 4.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.135 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -76.04 -40.54 53.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.907 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.644 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 16.0 t -78.32 -55.3 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -55.2 -22.08 16.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.64 -16.09 27.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.408 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.3 pp -102.84 158.54 16.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.89 0.376 . . . . 0.0 110.817 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -133.11 171.79 21.68 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.597 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.47 -134.78 5.65 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.427 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -179.21 153.52 12.49 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.527 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.14 -103.8 2.86 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.568 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -27.76 64.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 111.018 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.4 mt -68.06 -29.8 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.219 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.51 -56.12 21.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.178 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.57 -29.51 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.837 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.525 ' CD2' ' HB3' ' A' ' 63' ' ' GLU . 9.5 mt -72.08 -22.28 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.325 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -78.61 -59.16 2.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -58.87 5.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.794 0.331 . . . . 0.0 111.838 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.5 ttpm? -60.37 -25.05 65.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.75 -179.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.38 -57.57 11.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.639 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.532 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.36 -55.44 10.4 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.546 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.532 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.01 -28.62 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.006 0.431 . . . . 0.0 111.141 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.02 -38.24 75.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.165 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -58.02 8.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.375 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptmt -50.25 -31.78 14.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.378 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -66.76 -25.98 66.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.888 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 mt -74.13 -32.41 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 0.0 110.625 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -67.35 -36.34 81.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -71.02 -29.78 65.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.483 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.446 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 9.1 mt -61.76 166.35 4.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.72 -96.25 0.22 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.53 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.55 -141.48 11.51 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.496 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.53 157.06 28.54 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.599 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 124.75 -68.44 0.5 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -95.1 -22.72 17.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.794 0.331 . . . . 0.0 111.005 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.3 p -50.1 -28.33 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.53 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.62 -31.55 67.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.068 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -66.42 -57.25 7.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.0 t -58.99 -25.9 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.126 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -38.36 89.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -71.71 -27.88 63.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.638 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -69.75 -28.94 66.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.928 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.49 -25.45 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.046 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -74.58 -28.38 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.437 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.61 -43.44 48.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.503 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.463 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 1.7 tt -72.51 -25.04 61.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.59 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -69.76 -56.14 7.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.936 0.398 . . . . 0.0 110.557 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.49 -26.94 65.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.807 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.525 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.32 -48.41 78.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.943 -179.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.409 ' CG1' HD23 ' A' ' 30' ' ' LEU . 15.6 mt -65.75 -24.16 33.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.861 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -35.33 76.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.989 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -62.68 -58.54 7.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.929 -179.977 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.644 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.531 -0.228 . . . . 0.0 112.531 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m -153.26 110.28 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.884 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -176.5 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.2 p -73.83 -28.33 24.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.173 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -35.78 66.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.854 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.48 -25.91 54.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.96 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.64 -27.94 68.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.1 mt-10 -78.68 -32.57 47.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.639 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -20.47 56.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -74.81 -55.04 6.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.897 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 12.1 t -63.91 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.267 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -59.23 -36.84 76.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.438 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.95 -23.89 44.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.531 0.682 . . . . 0.0 109.414 178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tt -66.85 -24.99 66.2 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.856 -1.066 . . . . 0.0 110.86 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.425 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 34.3 tt0 -74.19 -49.77 22.11 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.63 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -50.71 -26.02 5.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.757 0.313 . . . . 0.0 111.341 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -75.11 -43.91 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.173 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.626 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.0 t -77.94 -56.26 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.334 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 22.2 mttt -51.82 -24.11 5.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.301 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.52 -18.81 28.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.142 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.3 pp -102.64 159.34 15.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.808 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -145.84 145.29 14.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.26 -128.17 1.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.428 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -173.76 155.35 21.83 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.461 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.19 -103.59 3.07 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.526 ' HG3' ' HA ' ' A' ' 67' ' ' LEU . 0.2 OUTLIER -56.56 -27.63 58.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.104 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.404 HG13 ' HD3' ' A' ' 26' ' ' ARG . 61.4 mt -74.19 -29.69 25.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.502 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -56.15 15.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.759 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -61.19 -37.58 83.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.417 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 71.5 mt -67.54 -21.41 65.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.801 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -78.03 -59.29 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -53.59 -34.8 59.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.748 0.308 . . . . 0.0 111.777 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.443 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.02 -24.78 35.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.823 -179.404 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.41 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.96 -58.0 8.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.03 -46.4 68.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.876 -178.809 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 3.5 tt0 -55.05 -28.17 50.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.057 0.456 . . . . 0.0 110.789 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 tp -69.33 -42.44 75.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.328 -179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -58.17 9.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.4 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -49.97 -32.8 15.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.444 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -66.46 -26.84 67.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.46 HG21 HD12 ' A' ' 41' ' ' ILE . 8.4 mt -74.81 -32.39 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.569 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.65 -33.18 74.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.413 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.42 -29.79 61.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.509 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.458 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 7.8 mt -60.18 -175.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.971 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.22 -56.92 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.466 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.81 46.49 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.529 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.47 151.06 5.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.523 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.52 -80.2 1.4 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.467 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -95.14 -17.58 21.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.699 0.285 . . . . 0.0 111.027 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.74 -29.56 7.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.482 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -66.17 -31.0 71.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.029 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.2 tptp -66.33 -57.25 7.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 44.8 t -55.49 -26.01 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.202 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.93 -36.58 84.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.57 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -73.79 -27.84 61.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.723 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -69.53 -28.69 66.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 10.2 t -82.76 -25.71 8.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.115 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.35 -28.38 59.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.597 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.08 -41.19 62.08 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.443 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.12 -26.17 47.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.54 -42.22 68.17 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.962 0.41 . . . . 0.0 110.735 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 65' ' ' LYS . 4.4 tt0 -74.26 -26.38 60.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.5 OUTLIER -64.38 -59.2 4.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.405 -179.531 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.414 HG21 HD12 ' A' ' 64' ' ' ILE . 37.9 mt -51.29 -26.58 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.044 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 2.4 mptp? -52.9 -38.72 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -95.6 -67.36 0.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.526 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.947 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.626 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.474 -0.251 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 p -110.99 111.79 23.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.855 0.36 . . . . 0.0 110.934 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -115.23 -66.79 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -81.15 -41.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.016 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -32.97 62.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.581 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.478 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -73.05 -25.65 61.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.875 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.55 -33.34 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -74.48 -30.4 61.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.496 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 pt-20 -77.01 -24.77 52.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -52.5 38.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.813 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.3 t -67.06 -29.21 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.351 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.06 75.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.78 -24.48 38.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 109.56 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.411 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.9 tt -64.99 -24.94 67.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.941 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' HA ' ' C2 ' ' A' ' 101' ' ' HTS . 0.6 OUTLIER -77.38 -55.34 5.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.607 -179.122 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -46.8 -27.72 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.513 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -76.1 -40.5 52.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.313 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.65 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 13.1 t -78.19 -45.48 26.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.484 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.22 -29.91 6.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.495 -179.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.55 -13.23 37.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.472 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.12 -69.7 0.32 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.978 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 122.35 -83.04 0.35 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.419 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.02 147.01 6.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.43 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -164.14 32.41 0.26 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.11 -78.53 1.93 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.519 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.402 ' HD2' ' CD1' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.96 -28.13 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 0.0 110.771 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.5 mt -67.78 -29.72 46.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.243 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -52.78 60.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.108 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -57.64 -30.39 65.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.923 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 1.0 OUTLIER -71.5 -21.86 61.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.306 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -78.09 -59.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.998 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.75 69.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.823 0.344 . . . . 0.0 111.809 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -24.94 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.809 -179.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.93 -57.96 8.99 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.631 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.85 -47.07 66.87 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -178.432 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.417 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.7 OUTLIER -55.07 -28.09 49.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.096 0.474 . . . . 0.0 110.844 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.405 ' CD2' ' HA ' ' A' ' 57' ' ' VAL . 7.1 tp -72.92 -39.0 66.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.431 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -53.08 62.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.451 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -27.99 68.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.384 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -67.09 -27.14 67.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.281 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.47 -33.59 23.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.881 0.372 . . . . 0.0 110.666 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.45 -31.46 72.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.21 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -77.11 -29.41 54.81 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.441 179.644 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.468 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 23.6 mt -60.93 175.44 0.5 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.002 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.28 -95.82 1.05 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.403 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -157.12 25.75 0.48 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 163.47 160.84 11.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.499 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.09 -92.58 1.65 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.538 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.17 -21.19 29.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.705 0.288 . . . . 0.0 111.201 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 29.3 t -53.34 -27.89 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.396 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -28.54 67.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.044 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.25 -57.17 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.936 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.5 t -52.47 -27.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.481 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -63.27 -30.99 72.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.983 0.421 . . . . 0.0 110.687 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -80.97 -27.83 35.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.831 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -67.95 -28.72 67.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.405 ' HA ' ' CD2' ' A' ' 37' ' ' LEU . 21.2 t -81.05 -25.84 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.969 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.01 -28.42 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.332 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.25 -37.15 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.451 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 4.0 tt -76.08 -28.67 57.67 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.087 -0.245 . . . . 0.0 111.393 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.5 -56.13 12.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.917 0.389 . . . . 0.0 110.652 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -62.26 -26.79 68.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.841 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.48 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.2 OUTLIER -61.82 -43.19 99.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.028 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.459 HG23 HD12 ' A' ' 64' ' ' ILE . 17.5 mt -65.72 -24.53 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.208 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.1 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.888 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.73 -61.55 2.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.831 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.408 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.073 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.65 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t -134.05 119.39 18.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.929 0.395 . . . . 0.0 110.861 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -176.23 -60.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.898 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.3 p -67.17 -27.82 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.172 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -54.76 -34.78 63.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.89 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.46 -25.86 41.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.0 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.03 -30.21 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.119 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.44 -33.11 66.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.381 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -19.6 56.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.534 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.12 -43.2 24.55 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 17.6 t -76.91 -29.39 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -63.07 -35.24 79.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.973 0.416 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.28 -26.76 35.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.606 0.717 . . . . 0.0 109.503 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tt -63.15 -25.46 68.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.814 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -76.86 -45.11 29.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.196 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.43 -29.03 22.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.143 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -45.95 30.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.62 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.9 t -70.87 -51.57 34.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.527 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.33 -31.01 13.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.364 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.2 -13.33 38.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.387 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.11 -69.07 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 149.59 -124.93 1.88 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.468 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -163.81 165.29 36.87 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.499 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 147.9 -115.41 0.75 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.494 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -103.92 -56.01 0.76 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.512 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.422 ' HG3' ' HA ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -61.49 -62.03 2.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.6 mt -51.04 -29.15 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.952 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -60.04 -56.35 22.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -56.61 19.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.979 0.419 . . . . 0.0 111.365 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.48 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 37.5 mt -53.01 -21.02 3.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.467 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.9 -59.25 2.86 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -39.15 58.64 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -80.77 -24.67 38.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.282 -0.417 . . . . 0.0 112.12 -179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.3 -57.77 9.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.649 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.421 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -68.54 -47.76 66.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.036 -178.687 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.421 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -54.43 -28.19 42.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.064 0.459 . . . . 0.0 110.973 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.39 -41.71 72.66 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.313 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -58.98 -58.08 10.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.352 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.31 -28.02 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.41 -26.31 63.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -74.22 -32.55 32.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.969 0.414 . . . . 0.0 110.628 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.61 -33.98 76.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.515 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.45 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -73.72 -29.26 62.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.646 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.45 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 6.2 mt -58.96 161.79 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.979 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -112.58 -75.13 0.71 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.553 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 168.97 57.51 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.561 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 138.89 144.65 4.64 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.546 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.28 -76.28 1.0 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.559 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -95.1 -20.04 19.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.701 0.286 . . . . 0.0 111.037 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -48.91 -30.64 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.447 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -29.9 65.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.917 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -66.71 -57.19 7.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.878 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.6 t -56.57 -29.51 29.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.141 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -62.25 -33.59 74.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.623 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -76.85 -28.01 55.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.786 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -67.58 -28.82 68.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.965 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.9 t -83.03 -25.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.998 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -74.11 -28.21 61.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.486 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.54 -41.45 54.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.91 -25.73 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -178.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.45 -53.96 14.26 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.991 0.424 . . . . 0.0 110.628 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -64.39 -26.89 68.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.185 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.412 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.4 mm-40 -61.9 -59.08 5.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.258 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 33.5 mt -54.28 -25.45 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -53.0 -38.64 62.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.724 0.297 . . . . 0.0 111.438 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.6 mttp -99.99 -67.18 0.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.864 0.364 . . . . 0.0 110.951 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.422 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.864 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.62 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 m -145.86 -47.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.922 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -161.79 -44.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.36 -33.94 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.172 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.7 -30.95 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.494 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -81.91 -25.69 34.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.215 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.72 -35.81 80.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -72.44 -31.34 65.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.596 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.494 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 4.4 pt-20 -77.25 -21.92 52.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.725 0.298 . . . . 0.0 111.378 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -54.98 9.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.235 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.7 t -67.76 -29.21 44.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.419 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -59.5 -36.65 76.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.634 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.03 -23.99 38.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.6 0.714 . . . . 0.0 109.541 178.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.24 -25.23 67.58 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.819 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -75.84 -46.02 32.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.012 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -53.17 -27.1 19.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.207 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -49.19 18.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.66 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 18.7 t -70.08 -55.2 15.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.376 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.2 mtpt -52.67 -24.53 8.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.492 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.92 -19.12 26.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.433 ' CD1' ' C ' ' A' ' 21' ' ' LEU . 1.6 tm? -78.66 146.92 33.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.248 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -56.01 -97.02 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.642 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -173.91 -179.91 44.86 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.664 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.22 -160.66 29.02 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.484 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -83.5 -57.89 2.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.437 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -61.41 2.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.014 0.435 . . . . 0.0 110.922 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.415 ' CG1' HD13 ' A' ' 21' ' ' LEU . 2.0 mp -51.75 -29.46 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.911 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -56.18 25.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.49 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.422 . . . . 0.0 110.962 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.494 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 2.4 mt -69.2 -21.27 63.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.618 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -77.72 -59.19 2.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -54.1 32.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.352 . . . . 0.0 111.583 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.409 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 9.3 tttp -65.1 -25.07 67.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.784 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.5 -57.53 12.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.476 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.08 -52.34 43.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.8 tm-20 -49.49 -28.38 5.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 111.106 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.7 tp -71.87 -41.89 67.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.58 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -58.29 9.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.707 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -33.02 9.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.636 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.42 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 tttt -67.85 -27.19 66.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.165 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -76.0 -31.49 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.868 0.366 . . . . 0.0 110.752 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -69.69 -31.41 69.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.6 pt-20 -76.05 -29.6 58.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.529 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 8.3 mt -61.18 159.23 12.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.018 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.36 -82.15 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.567 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -89.28 -114.04 1.38 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.518 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.04 -170.92 12.82 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.581 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.43 -63.2 0.97 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.487 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -95.05 -24.52 16.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.768 0.318 . . . . 0.0 110.937 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -54.35 -28.73 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.351 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -66.06 -32.84 74.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.153 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -69.69 -57.34 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.994 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.4 t -52.87 -25.81 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.432 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -65.87 -38.06 87.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.719 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -72.06 -27.78 62.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.84 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.84 -29.11 65.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.136 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.8 t -83.28 -25.85 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.116 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -75.31 -28.5 59.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.51 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -38.59 55.91 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.441 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.0 -25.34 47.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.616 0.246 . . . . 0.0 111.627 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -54.18 15.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.065 0.459 . . . . 0.0 110.466 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 -26.84 68.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.923 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.468 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.85 -51.19 70.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.166 -179.746 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.429 ' CG1' ' CD2' ' A' ' 30' ' ' LEU . 19.4 mt -62.03 -24.64 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.114 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -66.07 -31.87 73.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.969 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -66.65 -59.59 3.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.964 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.66 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -136.62 -178.6 5.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.838 0.351 . . . . 0.0 110.85 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 -40.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.44 -27.01 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.24 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.53 -38.84 64.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.868 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.6 -25.67 64.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.77 -29.18 67.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.168 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -78.73 -39.98 34.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.323 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -19.97 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.381 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -53.76 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.192 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 31.6 t -64.31 -29.31 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.41 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -37.1 75.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.729 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 -23.93 41.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.511 0.672 . . . . 0.0 109.517 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -65.22 -25.28 67.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.707 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -79.09 -47.4 16.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.079 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -51.36 -30.64 19.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.899 0.381 . . . . 0.0 111.082 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.4 tttm -76.15 -38.04 57.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.651 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 20.0 t -78.12 -56.26 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.399 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -52.74 -24.62 9.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.243 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -18.75 26.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.98 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.409 ' CD2' ' HA ' ' A' ' 18' ' ' VAL . 1.2 pp -103.29 159.24 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -171.31 152.32 17.74 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.641 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 114.87 95.52 2.06 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.539 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.87 157.12 8.58 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.548 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.89 -27.54 60.37 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.474 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.407 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.23 -37.27 72.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.864 0.364 . . . . 0.0 110.913 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.7 mt -63.41 -29.73 47.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.867 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.92 -56.18 17.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.628 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -27.09 67.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 96.5 mt -76.83 -21.54 54.89 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.552 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -78.33 -59.35 2.82 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -53.34 -36.24 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 111.727 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.77 35.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.842 -179.265 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.8 -57.71 9.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -44.94 72.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.885 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 52.9 tt0 -55.34 -28.04 51.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.161 0.505 . . . . 0.0 110.776 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.1 tp -70.97 -42.2 70.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.337 -179.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -57.96 -58.19 9.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.537 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -51.69 -28.36 14.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 -179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -70.74 -26.9 63.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.013 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.429 HG22 HD11 ' A' ' 41' ' ' ILE . 6.9 mt -77.73 -29.56 16.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.867 0.365 . . . . 0.0 110.749 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -38.98 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.423 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.7 pt-20 -68.17 -35.21 77.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.347 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.419 ' N ' ' HG2' ' A' ' 43' ' ' GLU . 7.0 mt -54.08 179.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.024 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -145.69 -67.15 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.486 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 143.52 93.27 0.17 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.418 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.62 -37.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.649 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -169.89 -39.83 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.769 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.581 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 4.8 tt0 -65.76 -14.68 61.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.62 0.247 . . . . 0.0 111.533 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.78 -14.69 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.706 0.288 . . . . 0.0 111.234 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -52.92 11.43 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -54.81 -57.2 12.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.5 t -55.66 -31.31 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.806 0.336 . . . . 0.0 111.246 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -61.95 -32.7 73.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -77.37 -27.74 52.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.841 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.02 -29.94 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 14.5 t -83.31 -25.56 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.179 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -28.18 61.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.376 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -37.83 59.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.757 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.472 ' O ' HG13 ' A' ' 64' ' ' ILE . 1.1 tt -78.09 -25.7 47.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.759 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.29 -55.53 8.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 110.496 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.28 -26.89 68.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.919 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.4 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 5.1 mt-10 -62.58 -49.35 75.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.464 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.532 ' HA ' HD21 ' A' ' 67' ' ' LEU . 25.7 mt -58.21 -27.75 33.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.075 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -67.35 -30.35 70.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.898 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -69.23 -53.62 18.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.532 HD21 ' HA ' ' A' ' 64' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.947 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.651 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.1 m -151.6 94.53 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -111.35 -45.82 3.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.7 t -75.96 -34.41 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.044 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -33.57 70.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.002 0.429 . . . . 0.0 110.618 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.49 -25.39 61.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.074 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.51 -38.21 74.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.596 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -74.53 -33.43 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.548 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.94 -19.72 57.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.21 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -42.79 47.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.143 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.9 t -74.12 -29.42 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.379 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -62.08 -36.02 80.41 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.347 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.22 -24.49 37.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.463 0.649 . . . . 0.0 109.54 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.4 tt -65.74 -25.24 67.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.745 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 35.6 tt0 -74.17 -40.31 62.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.167 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -53.63 -28.61 33.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.196 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 tptt -76.06 -43.8 42.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.601 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.4 t -73.97 -52.56 20.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.373 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.3 mttm -49.12 -31.71 8.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.321 . . . . 0.0 111.577 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.14 -12.28 61.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.499 ' N ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.89 174.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.297 -179.843 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.409 ' N ' ' CD2' ' A' ' 21' ' ' LEU . . . -134.27 -59.67 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.459 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -150.41 135.25 5.13 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.514 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.32 -167.81 39.6 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.636 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -113.37 -66.52 0.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.5 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.26 -27.8 4.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.72 0.295 . . . . 0.0 111.229 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.411 ' CG2' ' HG ' ' A' ' 21' ' ' LEU . 55.6 mt -65.01 -29.95 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.441 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -62.22 -56.06 22.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -58.84 -27.0 64.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.894 0.378 . . . . 0.0 110.836 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.498 ' CD2' ' HB3' ' A' ' 63' ' ' GLU . 4.9 mt -73.71 -23.4 59.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.292 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -78.32 -59.43 2.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -36.98 45.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.425 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.93 35.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.022 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.415 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.43 -57.85 8.1 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -178.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -43.51 73.8 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.594 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.29 -28.2 64.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.029 0.442 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.4 tp -69.13 -48.3 62.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.458 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -58.25 8.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.532 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -29.03 30.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.399 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 28.4 tttm -70.04 -26.25 63.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.123 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.2 mt -76.76 -32.34 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 0.0 110.712 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -69.0 -32.57 72.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.443 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.32 -29.97 60.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.518 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.476 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.2 mt -55.45 160.82 2.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.963 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.51 -101.03 2.57 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.511 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -128.15 -47.22 0.18 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.63 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -144.88 176.44 23.95 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.498 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.37 -81.4 1.38 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.505 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.14 -16.83 61.44 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.632 0.253 . . . . 0.0 111.3 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.1 t -56.0 -21.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.609 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -75.61 -25.95 57.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -78.01 -57.31 3.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.108 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.8 t -57.45 -29.8 34.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.369 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -38.57 90.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 110.649 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.69 -27.68 63.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.862 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.59 -29.28 66.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.307 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 15.4 t -83.21 -25.77 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.919 0.39 . . . . 0.0 111.187 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.84 -28.31 60.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.275 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmt? -75.16 -41.01 59.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.76 -179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.488 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 2.1 tt -73.59 -27.64 61.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.642 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.58 -56.04 11.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.885 0.374 . . . . 0.0 110.789 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -61.11 -26.93 68.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.498 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.91 -49.38 75.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.389 -179.485 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 16.8 mt -63.82 -24.46 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.755 0.312 . . . . 0.0 111.313 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 49.7 mmtt -55.99 -37.66 69.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.131 -179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.78 -54.24 24.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.699 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.4 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 1.8 pp . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.076 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.601 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.179 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.4 m -68.48 132.51 47.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.865 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.1 ttm-85 -122.71 -55.82 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.98 -29.82 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.264 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.69 -35.05 70.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.77 39.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.187 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.97 -28.49 69.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -73.33 -33.35 65.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.078 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -77.2 -20.01 55.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.302 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -45.63 65.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.255 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 t -75.91 -29.42 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.475 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -35.86 81.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.979 0.419 . . . . 0.0 110.173 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -24.06 37.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.515 0.674 . . . . 0.0 109.467 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.417 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.5 OUTLIER -66.05 -25.15 66.92 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.915 179.426 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.85 -56.13 4.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.365 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -47.04 -29.52 2.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.366 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -76.04 -39.53 55.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.003 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.634 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 25.0 t -78.09 -51.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.326 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -51.21 -29.87 15.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.408 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.93 -11.78 35.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.327 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.37 -69.75 0.31 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.868 0.366 . . . . 0.0 110.937 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 160.63 -120.71 0.97 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.445 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 172.32 157.59 14.53 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.579 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 97.52 95.19 1.92 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.504 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 115.31 -136.68 13.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.508 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.42 ' HG3' ' CD2' ' A' ' 67' ' ' LEU . 0.2 OUTLIER -56.88 -27.77 60.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 111.02 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -70.14 -29.66 40.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.282 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -56.09 22.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.75 68.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.475 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 9.3 mt -71.16 -21.62 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.612 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -78.53 -58.97 2.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.08 -59.04 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.41 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 4.1 ttpm? -61.22 -25.06 66.8 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.936 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.21 -57.63 11.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.34 -55.41 16.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.511 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.541 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 33.7 tt0 -48.47 -28.51 3.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.983 0.421 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.409 ' CD2' ' CG2' ' A' ' 57' ' ' VAL . 10.9 tp -70.32 -42.63 71.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.805 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -58.49 6.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 111.739 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.23 -27.94 10.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.513 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 7.9 ttpt -70.73 -28.22 64.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.093 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.14 -32.76 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.659 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.09 -33.38 74.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.344 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.451 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.4 pt-20 -73.98 -29.73 62.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.451 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 9.8 mt -62.25 162.69 9.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -128.31 -88.35 0.58 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.505 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -88.32 -100.84 0.94 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.519 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.34 -141.46 4.8 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.498 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.92 -81.32 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.489 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -68.53 -26.12 65.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.779 0.324 . . . . 0.0 111.002 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.28 -19.66 16.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.519 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -70.65 -35.06 72.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -73.56 -57.15 4.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 38.7 t -53.14 -25.96 10.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.309 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -35.83 82.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.609 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -74.54 -27.88 60.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.73 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -70.12 -28.73 65.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.409 ' CG2' ' CD2' ' A' ' 37' ' ' LEU . 15.9 t -83.1 -25.83 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -75.27 -28.42 59.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.533 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -76.06 -38.56 56.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.449 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.18 -25.09 47.0 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.598 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -54.18 15.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.001 0.429 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -64.76 -26.83 68.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.651 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.443 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -58.78 -56.2 25.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.9 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 23.5 mt -59.15 -24.5 27.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.187 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -31.54 72.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.88 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 mttm -64.62 -46.14 83.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.42 ' CD2' ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.901 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.634 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.584 -0.206 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.14 44.17 10.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.357 . . . . 0.0 110.821 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -101.68 -54.13 2.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.9 p -65.34 -29.2 46.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.178 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -57.43 -35.66 70.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.831 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.72 -25.87 54.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.157 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.85 -27.07 68.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.993 179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -75.12 -32.54 61.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.243 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -77.19 -20.68 55.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.245 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -68.86 -51.0 45.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.016 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 14.7 t -71.57 -29.14 33.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.492 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.9 ttpt -60.86 -36.38 79.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.441 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.1 -24.67 37.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.409 0.623 . . . . 0.0 109.559 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tt -65.49 -25.4 67.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.892 179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.439 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.7 tt0 -77.71 -47.76 18.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.25 -29.57 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.319 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -76.14 -40.01 53.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.652 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 10.1 t -78.01 -59.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.997 0.427 . . . . 0.0 111.235 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.439 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -51.49 -22.82 3.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.99 -18.28 29.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.379 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.5 pp -99.88 173.0 6.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.4 ' N ' ' CD1' ' A' ' 21' ' ' LEU . . . -144.66 150.42 22.55 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.517 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 150.89 -169.09 30.66 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.54 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -143.54 168.19 26.36 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.516 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.81 -98.42 2.28 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.569 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.403 ' HB3' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -54.67 -62.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.111 0.481 . . . . 0.0 110.842 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.9 mt -55.42 -29.55 24.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.803 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -56.24 20.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.666 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.16 -41.12 87.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.991 0.424 . . . . 0.0 110.853 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.525 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 2.9 mt -59.41 -21.13 59.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.702 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.4 -59.0 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -59.05 4.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.886 0.374 . . . . 0.0 111.691 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.427 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 1.3 ttpt -61.21 -24.86 66.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.845 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.525 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.38 -57.5 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.908 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.52 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.34 -54.63 16.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -178.471 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.52 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.52 -28.3 3.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.02 0.438 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.0 tp -69.13 -41.48 77.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.468 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -58.26 8.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.44 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -52.02 -27.93 15.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.409 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.25 -29.07 67.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.047 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.466 HD13 HG22 ' A' ' 41' ' ' ILE . 7.7 mt -75.2 -32.59 26.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 0.0 110.602 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -31.3 71.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.394 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.1 OUTLIER -76.37 -29.93 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.473 179.673 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.461 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 9.4 mt -61.6 159.69 12.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.976 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -142.27 37.05 1.6 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.489 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 67.79 149.93 0.2 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.439 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.72 -142.52 13.85 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.476 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -95.29 -36.72 5.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.47 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.14 -27.11 65.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 111.043 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -56.01 -26.3 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -62.93 -32.15 73.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.054 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.17 -57.19 13.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.85 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.9 t -57.46 -25.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.209 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.17 -32.92 74.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -27.85 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -70.08 -28.72 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.9 t -83.22 -25.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.062 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -28.63 59.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.587 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.24 -37.77 57.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.427 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 1.4 tt -78.04 -25.24 47.71 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.581 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -55.44 10.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.051 0.453 . . . . 0.0 110.268 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -63.56 -26.88 68.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.813 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.465 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 11.9 mm-40 -60.11 -50.99 71.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.976 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.42 ' CG1' ' CD2' ' A' ' 30' ' ' LEU . 22.1 mt -61.74 -24.18 33.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.17 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -30.66 71.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.023 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -65.9 -61.43 2.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.403 HD23 ' HB3' ' A' ' 26' ' ' ARG . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.989 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.652 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.395 -0.282 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t -116.96 159.98 21.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.84 0.352 . . . . 0.0 110.858 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.85 -55.13 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.883 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.19 -40.87 80.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.997 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.52 -31.98 64.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.804 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.401 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -80.84 -25.89 37.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.086 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.74 -28.31 68.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.224 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.56 -31.21 53.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.549 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 4.4 pt-20 -77.15 -22.4 52.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.714 0.292 . . . . 0.0 111.254 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -54.36 8.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 25.1 t -65.79 -29.41 46.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.492 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -59.03 -36.78 75.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.68 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.28 -23.97 40.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.488 0.661 . . . . 0.0 109.336 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.07 -25.25 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.82 179.316 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -78.34 -41.98 31.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.212 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -55.14 -30.98 60.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.031 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -76.08 -42.84 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.25 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.62 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.9 t -73.43 -52.55 21.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.475 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -50.01 -31.07 11.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.22 -10.89 36.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.36 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -72.33 -69.73 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.936 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 160.43 -122.68 1.14 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.489 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.79 128.35 0.98 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.526 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.02 90.61 0.27 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.515 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.37 -117.47 4.88 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.509 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -44.01 86.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.5 mt -64.94 -29.57 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.58 -56.35 23.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.708 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.68 -47.02 85.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.933 0.397 . . . . 0.0 111.182 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 76.4 mt -57.87 -21.06 41.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.86 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -74.51 -59.1 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -50.9 -46.81 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.76 -24.66 60.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.095 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.07 -57.78 9.5 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.585 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.497 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -70.29 -52.45 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.767 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.497 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.2 tm-20 -50.18 -28.2 7.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.159 0.504 . . . . 0.0 110.937 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 tp -69.86 -43.68 71.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.224 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.81 -58.29 9.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.314 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -52.62 -27.9 19.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.331 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 -25.78 63.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.216 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.2 mt -79.35 -32.81 15.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 111.042 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -66.65 -38.73 87.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.738 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -70.33 -37.54 74.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 13.2 mt -53.55 166.91 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.049 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -128.14 -84.18 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.503 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -168.31 106.17 0.25 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.544 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 82.78 147.1 6.64 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.524 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.2 -87.23 0.61 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.04 -19.81 19.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.728 0.299 . . . . 0.0 111.058 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -49.06 -29.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.519 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -71.98 -29.44 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -69.12 -57.34 5.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.069 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.6 t -56.85 -29.55 30.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.08 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -61.38 -40.41 94.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.49 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.93 -27.82 65.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.682 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -68.52 -28.66 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.006 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.5 t -82.76 -25.86 8.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.078 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt -75.12 -28.18 60.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.513 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -75.65 -38.39 58.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.22 -25.77 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -51.35 26.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.017 0.437 . . . . 0.0 110.738 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -67.64 -26.65 66.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.217 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.432 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.74 -59.06 5.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.434 -179.422 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.416 ' HA ' HD23 ' A' ' 67' ' ' LEU . 35.3 mt -50.31 -28.39 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.536 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -27.48 65.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.733 0.301 . . . . 0.0 110.895 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.33 -55.26 5.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.672 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 64' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.879 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.62 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.146 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.9 p -129.06 135.0 48.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.05 -50.74 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.846 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.4 t -82.95 -40.35 16.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -57.1 -32.0 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -77.22 -25.7 51.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.122 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.09 -39.54 90.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.325 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 62.6 mt-10 -67.62 -32.93 73.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.506 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 3.6 pt-20 -77.27 -20.1 55.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.734 0.302 . . . . 0.0 111.312 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -43.56 58.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 23.2 t -75.41 -29.3 21.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.475 -179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -62.75 -35.83 81.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 0.0 110.182 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 -23.86 37.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.549 0.69 . . . . 0.0 109.499 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.38 -25.49 66.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.875 179.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -74.93 -51.54 13.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.207 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -51.3 -27.33 9.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.128 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -76.05 -40.94 52.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.832 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.641 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 19.1 t -78.08 -52.6 15.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.068 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -55.55 -19.92 11.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.33 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.75 -17.57 26.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.43 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.5 pp -99.95 157.74 16.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.86 0.362 . . . . 0.0 110.808 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -132.78 161.27 24.04 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.643 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 149.85 -168.32 29.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.436 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.6 135.43 5.94 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.537 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 123.92 -111.1 1.56 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.55 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.414 ' HG3' ' CD2' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.99 -27.62 61.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.745 0.307 . . . . 0.0 111.063 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 58.8 mt -66.04 -29.73 47.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.464 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.21 -56.14 12.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.484 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -59.16 -26.87 65.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.78 0.324 . . . . 0.0 111.369 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 92.1 mt -79.56 -21.61 44.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.72 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -76.74 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.67 -51.55 55.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 111.742 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -66.74 -25.12 66.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.844 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.09 -57.62 11.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.533 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.06 -55.3 14.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 112.057 -178.672 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.533 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.23 -28.44 3.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.061 0.458 . . . . 0.0 111.336 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 tp -69.07 -41.7 77.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.486 -179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -58.17 8.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.628 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -52.1 -27.96 15.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.47 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.436 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 22.1 tttt -70.58 -25.56 63.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.446 HG23 HD13 ' A' ' 41' ' ' ILE . 6.9 mt -77.11 -40.79 30.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 111.089 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -65.89 -28.89 69.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.812 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 5.5 pt-20 -77.68 -30.92 52.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.375 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 mt -57.94 -176.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.935 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -151.87 -103.35 0.25 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.52 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -151.49 113.87 0.61 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.499 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 173.29 -144.72 7.92 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.561 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -94.96 12.28 68.66 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.797 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -95.08 -24.87 16.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.778 0.323 . . . . 0.0 110.963 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.6 t -56.11 -22.79 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.41 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.95 -29.89 55.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.897 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.03 -57.27 6.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.95 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.8 t -60.19 -29.87 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -62.51 -33.27 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.645 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -27.89 53.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.794 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -67.9 -29.21 68.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.7 t -83.26 -25.61 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.032 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -73.44 -28.15 61.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.35 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.014 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.4 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -74.07 -24.98 59.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.054 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -56.0 8.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.937 0.399 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -61.35 -26.99 68.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.153 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.406 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.3 tm-20 -61.99 -58.93 6.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.103 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.443 HD12 HG21 ' A' ' 64' ' ' ILE . 31.5 mt -52.89 -25.2 8.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.269 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -67.91 -44.93 75.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.414 ' CD2' ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.95 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.641 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 91.9 p -137.03 127.59 26.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.908 0.385 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 -138.14 -64.09 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.903 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.92 -43.7 20.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.129 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -31.66 61.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.806 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 -25.52 53.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.028 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.57 -35.42 78.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.35 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -74.39 -35.8 63.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.694 -179.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.61 -19.7 60.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.704 0.288 . . . . 0.0 111.523 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -73.07 -51.04 19.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.202 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.4 -29.21 43.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.648 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -36.71 77.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.99 -23.92 38.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.532 0.682 . . . . 0.0 109.508 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.401 HD21 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.31 -25.14 67.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.834 179.271 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.403 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 26.0 tt0 -75.1 -44.95 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.54 -26.12 12.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.99 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -76.08 -54.45 6.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.619 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.4 t -65.0 -53.45 41.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.261 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.1 mtpp -53.58 -26.55 22.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.22 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.69 -10.91 38.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.46 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -78.63 -157.55 0.12 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.626 -179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 164.39 107.86 0.21 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.482 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -156.48 -122.78 0.76 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.484 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 175.06 92.68 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.473 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.4 -99.96 0.21 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.478 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.66 61.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.739 0.304 . . . . 0.0 111.07 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.5 mt -73.94 -29.61 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.293 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -65.05 -56.14 14.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.599 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.46 -35.14 76.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 0.0 111.202 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 60' ' ' LEU . 96.0 mt -69.97 -21.42 63.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.659 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -76.64 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.628 0.251 . . . . 0.0 111.577 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.34 -37.08 62.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.581 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.408 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.48 -24.84 45.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.746 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -57.95 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -40.5 90.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.079 -178.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.12 -28.21 69.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 111.081 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.415 HD11 ' HA ' ' A' ' 57' ' ' VAL . 0.1 OUTLIER -70.18 -55.1 10.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.673 -179.107 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.96 -58.11 6.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 111.596 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.0 -27.92 8.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.413 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -71.09 -28.46 64.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.999 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.9 mt -75.07 -31.35 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.636 179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.92 -34.45 75.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -72.59 -29.76 63.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.461 179.559 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.456 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.6 mt -57.46 -175.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.945 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -151.4 -81.09 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -175.5 37.89 0.1 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.478 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.48 -160.94 26.06 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.555 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -87.57 8.37 77.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.851 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.15 -23.2 17.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.832 0.348 . . . . 0.0 110.979 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 p -52.55 -30.65 14.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.33 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -60.57 -27.14 67.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.139 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -68.52 -57.25 6.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.063 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 23.9 t -53.68 -26.08 12.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -65.2 -32.6 74.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.482 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.56 -27.94 51.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.705 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -68.62 -28.85 67.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.574 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.415 ' HA ' HD11 ' A' ' 37' ' ' LEU . 2.5 t -83.09 -25.52 8.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.894 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -28.18 61.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.527 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -75.27 -43.32 51.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.91 -25.15 58.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.999 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -54.1 12.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -62.87 -27.02 69.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.108 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.411 ' CG ' HD22 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.7 -59.0 5.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.438 HD13 HG23 ' A' ' 64' ' ' ILE . 29.9 mt -55.16 -26.15 17.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -61.72 -34.23 75.42 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.879 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -64.26 -56.04 17.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.8 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.422 HD23 ' HA ' ' A' ' 64' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.619 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.3 m -146.25 177.22 9.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.9 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.03 -66.89 0.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.6 t -72.82 -42.65 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -55.87 -31.84 63.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.757 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.75 -25.56 41.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.993 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.58 -28.96 68.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.272 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -79.01 -39.71 33.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -19.75 62.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.4 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -53.9 15.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.42 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 19.6 t -66.54 -29.3 46.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.754 -179.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -59.48 -36.71 76.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.628 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.42 -23.83 40.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.576 0.703 . . . . 0.0 109.393 178.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.41 -25.26 67.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.912 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -77.33 -52.89 8.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.241 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -49.99 -27.95 6.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.894 0.378 . . . . 0.0 111.197 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -76.09 -42.74 46.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.639 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 14.8 t -76.41 -48.44 27.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.02 -32.38 15.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.273 -179.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.1 -10.82 40.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.45 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.57 165.25 8.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.7 -123.03 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.42 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.5 124.59 1.12 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.469 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -157.57 -110.68 0.3 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -120.88 -56.91 0.23 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.621 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.4 ' CZ ' ' HB3' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.43 -27.72 62.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.76 0.314 . . . . 0.0 111.01 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 59.2 mt -67.65 -29.72 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.368 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.45 -56.18 12.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.659 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.63 -27.56 66.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.297 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.407 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 84.5 mt -78.87 -21.58 47.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.749 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.0 -58.66 3.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.715 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.35 -43.28 61.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.758 0.313 . . . . 0.0 111.824 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.402 ' HB3' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -75.06 -24.86 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.015 -179.239 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.25 -57.78 9.32 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.733 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.409 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.7 -46.54 68.72 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.409 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -54.22 -28.07 38.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.075 0.464 . . . . 0.0 110.855 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.8 tp -70.88 -42.74 69.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.529 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.3 9.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.797 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -51.34 -27.76 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.661 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -25.97 60.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.296 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.425 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 10.0 mt -71.26 -57.03 8.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.8 0.333 . . . . 0.0 110.681 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -23.93 64.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.128 0.49 . . . . 0.0 110.038 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -86.33 -12.98 47.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.206 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 2.2 mt -71.32 164.22 26.15 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.914 0.388 . . . . 0.0 110.902 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.97 -103.39 2.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.514 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -159.74 126.95 1.72 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.604 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 62.71 144.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.622 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.99 -88.91 1.43 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.654 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -57.26 -27.7 62.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.761 0.315 . . . . 0.0 111.163 -179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 27.1 t -55.34 -24.65 15.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.37 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -28.77 58.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.932 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -57.41 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.87 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 t -62.59 -26.02 39.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -67.09 -34.66 78.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.615 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.56 -27.96 58.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.798 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.57 -28.94 65.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.009 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.13 -25.84 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.168 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -28.48 59.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.655 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.31 -42.01 46.67 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.404 HD11 ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -75.48 -25.0 57.0 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.261 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.06 -55.35 9.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.984 0.421 . . . . 0.0 110.552 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.64 -27.0 68.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.242 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.21 -59.11 5.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.283 -179.639 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 30.3 mt -54.42 -26.41 15.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.211 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -33.35 75.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.1 mmtt -68.06 -58.99 3.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.956 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.639 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.35 -176.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 0.0 110.913 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 ttt85 -133.95 -63.04 0.75 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -74.15 -35.44 40.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.079 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.68 -28.07 66.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.02 -25.26 40.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.111 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 -32.22 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.358 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -83.09 -35.55 25.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.355 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -73.13 -19.72 61.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -55.05 8.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.991 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.3 t -63.89 -29.37 47.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.277 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -36.97 75.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -23.98 41.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.461 0.648 . . . . 0.0 109.635 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tt -65.39 -25.45 67.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.721 179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.411 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 36.3 tt0 -77.0 -40.57 46.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.246 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -54.29 -27.94 38.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 ttpm? -76.21 -47.67 23.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.6 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.6 t -70.55 -53.31 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.445 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.411 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.0 mttt -50.05 -30.82 11.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.478 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.21 -10.99 60.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.541 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.503 ' N ' HD12 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.82 167.56 4.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.456 -179.714 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -154.58 22.5 0.63 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.605 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.63 -121.87 2.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.518 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.01 173.33 46.19 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.91 -114.24 4.59 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.475 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.41 ' CD ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -52.8 -43.53 65.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.048 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.401 ' CG2' ' HG ' ' A' ' 21' ' ' LEU . 3.6 mt -59.7 -29.41 42.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.754 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -56.27 24.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -58.25 -38.59 77.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.453 . . . . 0.0 111.187 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 16.2 mt -66.15 -21.09 66.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.657 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -75.45 -55.93 5.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -53.83 -51.45 63.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.735 0.302 . . . . 0.0 111.606 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.15 -25.05 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.931 -179.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.86 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.04 -54.27 19.61 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.516 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.2 tt0 -48.53 -28.37 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.062 0.458 . . . . 0.0 111.19 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.87 -41.14 78.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.259 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -61.7 -58.27 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.15 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -27.98 25.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.3 tttt -68.9 -27.43 65.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.967 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -73.88 -31.06 29.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.903 0.382 . . . . 0.0 110.653 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -69.56 -34.6 74.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.423 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -72.53 -29.1 63.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.6 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.427 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.4 mt -58.34 169.33 0.89 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.994 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -132.99 -117.39 1.82 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -73.27 -138.79 0.36 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.511 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -91.74 177.25 40.22 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.613 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.8 -79.36 0.8 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.496 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -63.08 -18.0 62.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 111.191 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.22 -16.92 17.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.565 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.19 -33.21 65.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.796 0.332 . . . . 0.0 111.098 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -65.99 -57.28 8.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.89 -25.73 33.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.216 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.32 -37.28 85.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.72 -27.74 62.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -70.67 -29.7 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.031 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 19.8 t -83.33 -25.87 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.204 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -75.34 -28.42 59.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.667 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -41.28 57.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.16 -26.16 47.61 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -178.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -70.53 -49.38 48.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.088 0.47 . . . . 0.0 110.728 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.11 -26.82 65.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.4 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.402 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -63.41 -59.1 5.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.29 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.446 ' HA ' HD21 ' A' ' 67' ' ' LEU . 39.6 mt -50.58 -28.41 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.387 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -64.43 -31.49 72.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -71.61 -55.83 7.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.628 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 64' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.866 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.6 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.141 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.1 p -152.05 31.18 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.744 0.307 . . . . 0.0 110.871 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -139.34 -75.4 0.36 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.896 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.1 t -66.67 -30.76 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -57.88 -30.73 66.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.65 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.67 -25.36 49.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.085 179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -31.49 69.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.301 -179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -82.24 -37.99 25.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.58 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.05 -19.87 62.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.782 0.325 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -52.84 10.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.896 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.1 t -61.71 -29.19 45.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.426 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -37.26 73.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.774 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 -24.34 40.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.477 0.656 . . . . 0.0 109.611 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.404 HD22 HD23 ' A' ' 60' ' ' LEU . 3.2 tt -65.36 -25.18 67.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.761 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.429 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 56.8 tt0 -79.09 -42.72 25.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.353 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -53.7 -27.54 28.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.105 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 tppt? -76.16 -48.36 20.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.249 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.634 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.2 t -70.78 -49.6 49.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.618 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.429 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 10.2 mttt -51.24 -31.73 21.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.798 0.333 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.32 -10.85 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.419 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.67 165.29 24.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.664 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -67.86 -81.01 0.19 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.315 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 129.78 128.85 3.06 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.561 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.5 88.39 0.23 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.525 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 115.61 -117.34 3.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.583 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -27.54 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.798 0.333 . . . . 0.0 111.023 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.3 mt -73.55 -29.61 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.467 -179.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -56.18 18.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.684 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.91 -42.82 94.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.392 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 53.7 mt -63.63 -21.41 66.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.811 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -75.81 -59.08 2.91 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.2 tttp -50.59 -56.32 12.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.768 0.318 . . . . 0.0 111.753 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.418 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.74 -24.99 67.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.767 -179.422 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.04 -57.88 10.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.555 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.14 -56.44 9.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.072 -178.498 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.555 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -47.94 -28.36 2.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.388 . . . . 0.0 111.412 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 tp -67.54 -39.88 85.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.344 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -58.2 5.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.469 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.424 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -52.89 -27.68 19.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.341 -179.743 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.6 tttt -68.5 -28.73 67.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 mt -73.63 -31.0 30.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.657 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.19 -33.93 74.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.466 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -73.24 -29.2 62.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.62 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.438 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.7 mt -59.11 163.44 3.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.901 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.83 -44.71 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.483 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 139.77 127.46 2.41 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.603 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 166.13 -34.22 0.23 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.58 -28.47 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.472 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.96 -21.31 58.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.706 0.289 . . . . 0.0 111.118 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -53.37 -24.69 9.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.439 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -72.43 -36.5 68.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.89 0.376 . . . . 0.0 110.973 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -62.96 -57.23 11.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.3 t -57.93 -28.05 32.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.372 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.46 -36.24 83.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 110.728 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.34 -27.73 60.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.969 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.27 -29.26 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.377 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 17.5 t -83.27 -26.67 7.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.347 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.47 -28.38 59.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.691 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -76.79 -40.77 47.02 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.418 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.08 -25.81 47.84 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.978 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 -52.41 17.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.878 0.371 . . . . 0.0 110.55 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.46 -26.97 68.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.085 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.48 -59.13 5.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.437 ' HA ' ' HG ' ' A' ' 67' ' ' LEU . 35.2 mt -55.01 -25.69 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.254 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.02 -31.85 61.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.369 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -105.08 -69.35 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.236 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.437 ' HG ' ' HA ' ' A' ' 64' ' ' ILE . 87.5 mt . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.634 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.576 -0.209 . . . . 0.0 112.576 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -110.73 133.13 53.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.902 0.382 . . . . 0.0 110.909 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.96 -48.54 2.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 p -82.95 -33.44 10.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.125 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -58.29 -33.86 69.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.836 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.49 -25.88 35.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.07 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.6 -28.03 68.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.065 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' CG2' ' A' ' 41' ' ' ILE . 53.7 mt-10 -75.5 -37.0 60.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -19.95 60.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.432 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.22 -48.81 40.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.006 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.6 t -68.64 -29.3 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.514 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.0 -36.52 77.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.458 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -23.86 40.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.639 0.733 . . . . 0.0 109.407 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.4 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.71 -25.22 67.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.982 179.38 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -75.87 -55.33 5.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.398 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -47.14 -30.91 3.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -37.94 57.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.769 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.617 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 21.4 t -78.15 -48.66 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.303 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -31.55 17.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.335 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.16 -10.98 39.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.542 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.45 -69.0 0.33 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.841 0.353 . . . . 0.0 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.03 -117.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.528 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 164.13 126.58 0.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.508 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 149.65 84.83 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.55 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.0 -118.15 4.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -27.81 69.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.6 mt -65.42 -29.76 48.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.501 -179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -64.66 -56.25 15.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.661 -179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.06 -26.89 66.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.727 0.298 . . . . 0.0 111.226 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.441 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 87.9 mt -77.21 -21.77 53.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.517 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -59.44 2.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.688 0.28 . . . . 0.0 111.724 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.03 -37.82 61.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.786 0.327 . . . . 0.0 111.722 -179.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.77 -24.87 41.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.831 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.7 -57.96 8.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.794 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.04 74.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.552 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -27.98 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.189 0.519 . . . . 0.0 110.561 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.5 tp -76.55 -38.9 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.536 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -28.48 69.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.107 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -79.05 -27.63 43.13 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -73.13 -34.18 65.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.49 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.409 HG21 HD12 ' A' ' 41' ' ' ILE . 12.3 mt -67.37 -57.7 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.721 0.296 . . . . 0.0 110.701 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -58.28 -23.97 57.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.195 0.521 . . . . 0.0 110.044 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -84.81 -12.88 52.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.162 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 41' ' ' ILE . 4.2 mt -77.58 162.49 27.04 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.939 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -117.04 -63.06 0.32 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.406 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 148.69 137.6 2.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.519 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.69 -99.31 0.19 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.525 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -122.26 -38.38 0.6 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.457 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.8 -25.07 60.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.748 0.309 . . . . 0.0 111.115 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.69 -22.19 14.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.417 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -72.99 -29.73 63.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.1 -57.29 6.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.867 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.91 -28.1 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 -37.78 88.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.81 -27.99 63.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.728 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.57 -30.28 69.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.9 t -83.03 -25.55 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.164 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.7 -27.92 61.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.458 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.24 -40.94 58.52 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.401 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.5 OUTLIER -76.89 -25.09 52.63 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.032 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -53.74 14.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.639 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -64.75 -26.89 68.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.406 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.26 -59.09 5.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.47 HD12 HG23 ' A' ' 64' ' ' ILE . 28.1 mt -56.42 -25.41 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.231 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.36 75.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.922 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 39.9 mtpt -71.25 -57.75 4.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.738 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.896 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.617 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 p -64.66 155.45 33.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.78 -67.08 0.16 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.899 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -82.94 -37.76 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.205 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -32.85 67.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.674 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.66 -25.5 53.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.032 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -30.47 68.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.334 -179.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -80.27 -37.69 32.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.504 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -19.74 61.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.348 -179.799 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -48.96 25.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.447 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 17.8 t -68.21 -29.2 43.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.709 -179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -36.49 77.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.606 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.05 -24.0 38.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.445 0.64 . . . . 0.0 109.768 178.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tt -66.37 -25.08 66.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.753 179.497 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 27.6 tt0 -77.27 -46.46 23.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -179.626 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -49.6 -27.86 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -76.21 -48.69 19.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.388 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.598 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.7 t -70.0 -51.46 39.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.7 mttt -51.0 -31.17 17.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.798 0.333 . . . . 0.0 111.129 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.62 -10.91 47.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.472 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.73 165.48 23.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 -179.986 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -154.35 93.88 0.14 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.516 -179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.97 -139.01 2.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.588 179.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -164.36 -173.61 33.21 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.472 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.64 -110.62 3.13 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.509 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -27.74 63.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.725 0.298 . . . . 0.0 110.955 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 29.4 mt -67.63 -29.79 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.711 -179.352 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -43.65 71.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.93 -179.179 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -70.14 -26.85 64.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.685 0.279 . . . . 0.0 111.432 -179.419 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 72.8 mt -81.06 -21.62 39.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.494 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.74 -59.15 2.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.343 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -52.64 -48.23 66.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.64 -179.539 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.22 -25.2 65.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.736 -179.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.25 -57.87 9.83 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.001 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.541 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.87 -55.06 18.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.904 -178.596 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.541 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.7 tt0 -49.33 -28.47 4.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.96 -38.56 82.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.281 -179.658 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -66.48 -58.36 5.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.259 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.426 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 3.1 pttt -51.61 -27.51 11.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.202 -179.871 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.464 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 2.7 tptm -70.8 -25.81 63.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.456 HG21 HD11 ' A' ' 41' ' ' ILE . 8.0 mt -75.71 -42.1 40.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.08 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.26 -30.72 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.608 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 2.9 pt-20 -75.62 -30.66 59.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.095 0.474 . . . . 0.0 110.513 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.431 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.3 mt -56.86 162.4 2.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.791 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.96 -96.58 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.662 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -161.94 57.27 0.3 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -113.81 -27.46 3.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.542 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.79 -16.39 4.0 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.692 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.7 tt0 -62.14 -17.28 57.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 111.334 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.3 t -52.5 -25.11 7.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.302 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.55 -28.6 65.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -73.29 -57.18 4.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -55.51 -26.3 19.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.479 -179.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -65.41 -38.05 88.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.99 0.424 . . . . 0.0 110.591 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -72.32 -27.61 62.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.893 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -71.41 -28.9 64.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.493 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.9 t -83.32 -27.7 7.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.283 -179.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -75.61 -28.42 58.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.653 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -76.29 -40.18 52.33 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -178.81 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.4 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.07 -26.16 48.05 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -71.05 -49.47 44.4 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.934 0.397 . . . . 0.0 110.637 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.72 -26.9 65.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.238 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -62.36 -59.26 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.095 -179.631 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 39.1 mt -51.31 -25.86 4.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -33.99 75.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -43.82 79.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.818 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.015 179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.598 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.94 -175.77 2.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.809 0.337 . . . . 0.0 110.827 -179.911 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 19.8 ttm-85 -84.14 -31.78 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.1 t -66.77 -28.09 42.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.194 -179.969 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -37.3 66.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.406 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -73.67 -25.85 60.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.059 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.15 -29.31 69.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.195 -179.804 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -76.76 -31.38 57.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.601 -179.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 5.8 pt-20 -77.05 -22.34 53.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.731 0.3 . . . . 0.0 111.307 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.28 -55.04 8.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.01 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.3 t -65.4 -29.38 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.508 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.45 -37.18 74.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.718 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.05 -24.26 40.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.613 0.72 . . . . 0.0 109.468 178.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -64.52 -25.2 67.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.815 179.237 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.414 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 47.6 tt0 -77.56 -43.89 30.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.277 -179.417 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -52.94 -29.69 30.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.188 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -76.03 -50.57 14.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.346 -179.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.667 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 28.3 t -66.19 -53.1 40.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.509 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.414 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.5 mttt -50.52 -30.51 13.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.353 -179.497 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.06 -11.06 36.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.435 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.99 -70.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.106 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.56 163.06 38.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.508 -179.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.29 -163.43 15.75 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.525 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.71 -179.75 19.07 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.508 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.59 -101.96 2.18 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.47 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.411 ' HB3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.28 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.932 0.396 . . . . 0.0 110.906 179.919 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 2.8 mp -55.88 -29.46 26.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.769 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.23 -56.27 24.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.201 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.02 -32.57 69.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 111.091 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 4.5 mt -70.7 -21.13 62.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.555 -179.667 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -78.1 -57.61 3.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.048 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -58.42 6.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.85 0.357 . . . . 0.0 111.789 -179.138 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.2 -25.02 67.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -179.338 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.521 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.15 -57.53 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.912 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.507 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.77 -54.12 26.01 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.596 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.507 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.5 tm-20 -47.94 -28.38 2.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.033 0.444 . . . . 0.0 111.204 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.96 -40.58 71.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.3 -179.563 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -61.88 -58.33 8.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.604 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -51.42 -28.04 11.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.386 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.401 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.0 -28.66 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.88 -179.955 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.8 mt -75.18 -31.61 24.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.673 179.654 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -69.77 -31.45 69.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.392 179.642 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -75.61 -29.47 59.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.483 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.434 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.6 mt -56.82 -178.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.954 179.975 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.98 -72.14 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.48 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.36 -138.21 4.19 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.494 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.06 174.56 54.89 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.528 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 101.31 -68.4 0.43 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.553 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -95.04 -21.2 18.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.821 0.343 . . . . 0.0 111.069 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.9 p -50.7 -29.55 7.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.53 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -72.06 -29.91 64.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.158 -179.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -67.4 -57.25 6.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 -179.821 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 43.6 t -59.61 -25.92 33.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.53 -37.08 85.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.95 0.405 . . . . 0.0 110.472 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.04 -27.87 62.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.719 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.98 -29.01 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.031 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 22.3 t -83.23 -25.69 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.177 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -75.2 -28.34 59.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.506 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -39.44 59.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.646 -179.088 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.426 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -77.25 -24.88 51.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.54 0.21 . . . . 0.0 111.52 -179.566 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -55.01 13.07 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.008 0.432 . . . . 0.0 110.283 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.94 -26.92 68.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.976 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.429 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.8 mt-10 -60.45 -51.33 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.026 -179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 24.4 mt -59.39 -25.68 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -34.68 75.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.833 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.4 -64.35 0.98 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.756 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.428 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 2.4 pp . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.132 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.667 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -119.11 147.68 43.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -107.45 -61.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.855 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.67 -37.23 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.179 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -27.57 63.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.81 179.829 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.096 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -30.93 67.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.173 -179.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -83.16 -39.71 20.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -19.71 64.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.147 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.67 -55.13 9.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.0 t -62.56 -29.34 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.52 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -36.98 75.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.654 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.75 -23.87 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.566 0.698 . . . . 0.0 109.721 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.411 HD23 ' CD2' ' A' ' 60' ' ' LEU . 4.0 tt -66.61 -25.09 66.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.919 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -79.12 -52.71 7.82 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.438 -179.455 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -47.36 -30.23 3.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.837 0.351 . . . . 0.0 111.329 -179.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 15.5 tttm -76.19 -36.86 58.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.011 179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.632 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 24.9 t -78.21 -54.22 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.35 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -50.53 -29.83 11.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.44 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.35 -12.83 36.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.444 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.79 -60.74 2.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.945 -179.907 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.09 -95.09 0.24 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.528 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 174.25 176.52 42.71 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.516 -179.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.03 -114.29 0.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.487 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -115.34 -72.48 0.52 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.505 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -27.7 59.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.888 0.375 . . . . 0.0 111.099 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.2 mt -68.29 -29.6 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -179.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.05 -56.12 17.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.702 -179.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -57.86 -35.95 71.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 0.0 111.223 -179.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.445 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 64.9 mt -70.72 -21.32 62.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.691 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -75.28 -59.14 2.88 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -51.97 41.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.196 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.442 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 5.1 ttpt -67.55 -24.93 65.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.413 . . . . 0.0 112.084 -179.198 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.91 -57.74 11.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.951 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.66 -54.09 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.055 -178.704 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.515 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 5.9 tt0 -48.25 -28.57 3.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.075 0.464 . . . . 0.0 111.103 -179.826 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.4 tp -69.47 -40.29 77.2 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.186 -179.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -58.13 9.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.358 -179.769 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -54.65 -29.44 52.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.293 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.45 -26.82 68.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.0 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.39 -30.2 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 110.819 179.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.11 -45.8 83.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.616 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -62.14 -38.87 90.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.378 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.0 mt -51.19 173.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.072 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -137.94 -76.82 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.553 -179.912 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 173.73 54.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.507 179.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.83 -117.2 2.15 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.48 179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -106.66 -25.23 6.34 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.622 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.83 -27.67 60.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.702 0.287 . . . . 0.0 111.035 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 16.1 t -54.91 -23.89 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.341 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -72.36 -34.96 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.012 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -66.6 -57.32 7.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -57.55 -25.95 25.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.342 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -66.0 -37.74 86.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.921 0.391 . . . . 0.0 110.62 179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.37 -27.89 62.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.859 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -71.07 -28.89 64.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.32 -25.98 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.037 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -75.46 -28.61 59.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.795 -179.49 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -39.96 63.05 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -178.91 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.442 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.38 -26.21 46.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.228 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -40.35 70.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.969 0.414 . . . . 0.0 110.892 -179.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -76.48 -26.83 55.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.227 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.51 -59.28 4.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.153 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.482 HD11 HG22 ' A' ' 64' ' ' ILE . 38.7 mt -51.97 -27.95 9.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -62.17 -33.15 73.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.33 -52.41 27.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.858 179.984 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.937 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.632 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.17 88.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.972 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -75.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.932 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.0 -46.7 18.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.243 179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -54.67 -31.37 57.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.819 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.18 -25.87 31.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 179.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.81 -30.96 71.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.149 -179.896 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -71.32 -33.89 70.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.21 -19.53 56.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.509 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.58 -39.07 32.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.814 -179.232 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.1 t -79.16 -29.55 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.121 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -65.51 -34.68 78.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.054 0.454 . . . . 0.0 110.087 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.63 -25.07 35.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.606 178.463 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.446 HD23 ' CD2' ' A' ' 60' ' ' LEU . 3.7 tt -66.55 -25.6 66.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.863 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -76.77 -46.33 25.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.018 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -51.75 -27.05 10.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.02 -43.85 42.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.069 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.595 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.3 t -76.78 -57.45 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.258 -179.807 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -53.06 -23.83 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.236 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -18.14 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.125 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pp -103.15 171.31 7.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.941 179.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -178.54 146.04 7.16 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.519 179.871 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.71 87.31 1.87 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.574 179.985 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.96 134.89 2.26 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.577 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.16 -38.95 95.21 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.582 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -27.65 54.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.322 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 53.7 mt -65.08 -29.64 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.479 -179.63 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -64.15 -56.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.697 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.13 -28.02 67.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.693 0.282 . . . . 0.0 111.328 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 88.5 mt -76.5 -21.62 55.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.639 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -78.22 -59.52 2.74 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.42 -36.96 46.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.829 -179.258 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.6 ttpt -82.19 -24.81 34.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.141 -179.152 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.12 -57.88 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.479 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -42.46 79.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.564 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.85 -28.2 67.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.096 0.474 . . . . 0.0 110.918 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 tp -69.04 -44.74 72.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.554 -179.29 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -59.88 -58.25 9.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.777 0.322 . . . . 0.0 111.544 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -54.31 -27.81 38.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.22 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.413 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 1.7 tptp -67.63 -25.98 66.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.057 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.416 HG22 HD12 ' A' ' 41' ' ' ILE . 7.2 mt -77.1 -34.01 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.86 0.362 . . . . 0.0 110.48 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.6 -30.81 71.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.385 179.391 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.8 pt-20 -78.01 -29.45 49.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.477 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.438 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 14.6 mt -58.82 154.27 15.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 -179.92 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.78 -98.84 2.46 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.584 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -152.31 97.41 0.17 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.523 -180.0 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.8 147.15 8.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.449 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.26 -94.23 1.54 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.531 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.267 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.29 -19.7 24.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.445 179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -76.94 -26.48 54.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.331 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -57.14 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 0.0 110.591 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.3 t -54.04 -31.98 22.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.282 -179.995 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -59.17 -38.99 81.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.983 0.42 . . . . 0.0 110.616 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -71.88 -27.69 63.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.743 179.631 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -67.1 -28.62 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 11.0 t -82.38 -25.6 8.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.037 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.19 60.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.466 -179.619 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.19 -40.48 52.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -178.919 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.446 ' CD2' HD23 ' A' ' 14' ' ' LEU . 1.1 tt -77.0 -24.83 52.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.23 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.69 -54.63 11.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.02 0.438 . . . . 0.0 110.483 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -63.61 -26.96 68.92 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.961 179.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' CG ' HD23 ' A' ' 30' ' ' LEU . 1.9 tm-20 -61.27 -58.71 7.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.048 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.415 HG23 HD13 ' A' ' 64' ' ' ILE . 32.1 mt -54.08 -27.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.197 179.843 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -32.9 74.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -56.73 6.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.701 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.953 179.953 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.595 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 m -113.28 140.3 48.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.837 0.351 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -55.69 0.18 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.86 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -83.1 -32.21 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.126 -179.846 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -58.05 -33.53 69.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.77 -25.86 34.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.16 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.38 -30.02 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.047 -179.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.02 -33.7 68.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.263 -179.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.25 -19.94 55.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.473 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -45.52 65.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.46 -179.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 22.0 t -78.38 -29.18 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 -179.394 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -35.6 81.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.141 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -26.59 35.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.476 0.655 . . . . 0.0 109.62 178.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.402 HD21 ' CD2' ' A' ' 60' ' ' LEU . 4.0 tt -64.38 -25.39 68.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.913 179.557 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.86 -45.51 24.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.0 -26.82 11.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.903 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -48.6 19.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.631 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.3 t -70.9 -56.04 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.58 -20.49 8.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.05 -16.01 27.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.633 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' A' ' 18' ' ' VAL . 1.5 pp -100.44 -36.92 9.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.764 0.316 . . . . 0.0 111.002 -179.86 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.59 -146.53 18.84 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.76 179.79 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.61 156.39 26.97 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.548 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 141.36 126.53 2.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.578 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.96 -130.35 33.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.492 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.4 ' CZ ' ' CB ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -53.4 -27.84 26.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 -179.915 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.7 mt -68.79 -29.64 44.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.442 -179.485 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.91 -56.07 17.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.527 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -55.95 -26.9 50.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 -179.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.453 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 56.1 mt -81.09 -21.14 40.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.785 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -74.43 -54.42 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.722 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -54.55 -52.11 63.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.752 0.311 . . . . 0.0 111.761 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.465 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.9 ttpp -66.69 -25.08 66.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.924 -179.408 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.75 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.067 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.553 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.99 -56.16 11.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.127 -178.593 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.553 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 20.3 tt0 -47.85 -28.5 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 111.348 -179.688 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.2 tp -68.99 -38.68 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.472 -179.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -66.38 -58.26 5.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.399 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -52.19 -28.02 16.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.449 -179.629 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -69.34 -25.91 64.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mt -77.8 -34.91 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 110.734 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.93 -29.67 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 179.719 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.491 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -78.5 -30.89 47.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 110.575 179.734 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.491 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 8.5 mt -59.33 167.86 1.7 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.869 179.985 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -145.98 -47.02 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.388 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -176.3 41.69 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.447 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.86 -119.76 5.85 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.492 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -131.2 18.54 4.98 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.62 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -95.13 -25.83 16.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.781 0.324 . . . . 0.0 110.922 179.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.05 -30.17 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.281 -179.904 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -67.64 -38.57 84.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -60.18 -57.19 13.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.993 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.4 t -56.78 -25.87 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.72 -38.53 89.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.883 0.373 . . . . 0.0 110.592 179.853 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.36 -27.86 63.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.804 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.62 -28.9 65.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.06 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 23.0 t -83.12 -25.82 7.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.42 -28.49 59.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.668 -179.538 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.84 -40.52 63.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.875 -178.992 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.465 ' CD1' ' HB3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.18 -25.83 47.36 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.238 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -71.79 -40.05 69.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.945 0.403 . . . . 0.0 110.794 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.38 -26.88 56.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.272 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -63.87 -59.11 4.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -179.68 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 35.3 mt -51.87 -26.48 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.236 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -31.65 69.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -70.77 -57.38 4.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.766 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.4 ' CB ' ' CZ ' ' A' ' 26' ' ' ARG . 4.2 pp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.014 -179.957 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.631 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.551 -0.22 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.1 t -160.6 122.33 3.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.806 0.336 . . . . 0.0 110.905 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.67 -58.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 -179.927 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.4 p -71.32 -27.97 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.61 -36.73 69.76 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.837 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.69 -25.81 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.998 179.787 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -68.07 -28.43 67.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.153 -179.969 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.47 -31.84 58.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.536 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.29 -23.92 51.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.552 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -55.2 14.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 111.338 -179.393 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.7 t -70.03 -28.96 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.519 -179.608 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.0 -36.14 78.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.463 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.33 -24.42 39.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.513 0.673 . . . . 0.0 109.445 178.67 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.15 -25.22 66.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.938 179.361 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.428 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.4 tt0 -70.7 -47.04 61.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.24 -179.373 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -50.05 -26.58 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.216 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -76.1 -43.74 41.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.536 -179.775 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.575 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.7 t -78.13 -43.48 27.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.409 -179.498 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.7 mtpt -49.79 -36.52 26.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.028 0.442 . . . . 0.0 110.737 179.777 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.47 -10.95 35.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.795 179.294 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.414 ' CD2' ' CD1' ' A' ' 67' ' ' LEU . 4.8 tp -72.51 -46.9 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.105 -179.56 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 110.92 -137.66 14.45 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.596 179.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -160.34 178.35 36.41 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 148.06 -77.47 0.24 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.528 -179.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.31 -88.76 0.59 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.504 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.401 ' HG3' ' CD2' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.41 -27.89 64.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.845 0.355 . . . . 0.0 110.988 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mt -73.37 -29.83 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.13 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -65.68 -56.18 13.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.586 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.03 -36.03 74.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.865 0.364 . . . . 0.0 111.281 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' A' ' 60' ' ' LEU . 96.6 mt -70.7 -21.62 62.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.833 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.47 -57.25 4.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -54.83 -42.33 71.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.217 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.26 -25.45 60.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.638 -179.502 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.12 -57.81 10.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.938 0.399 . . . . 0.0 111.913 -179.167 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.37 -53.22 38.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.929 -178.801 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.505 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.2 tt0 -49.21 -28.55 4.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 111.176 -179.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 tp -71.44 -38.79 71.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.501 -179.522 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -58.34 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.73 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.43 -28.13 12.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.476 -179.512 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -28.66 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.974 -179.876 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.452 HD13 HG21 ' A' ' 41' ' ' ILE . 7.2 mt -75.77 -31.92 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.896 0.379 . . . . 0.0 110.506 179.707 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -68.1 -31.88 71.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.385 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.467 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -75.8 -29.75 58.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.421 179.496 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.467 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 14.1 mt -66.7 179.29 1.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.982 179.971 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -134.07 -74.61 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.997 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.89 109.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.441 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.82 170.0 39.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.466 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 79.88 -106.86 2.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.397 -179.987 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.49 -24.31 67.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.706 0.288 . . . . 0.0 111.038 179.988 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -54.2 -24.1 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -66.74 -36.75 83.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -70.65 -57.11 5.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.878 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.6 t -50.24 -26.34 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.465 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.2 -32.67 74.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -27.95 47.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.725 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -68.66 -28.87 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 30.9 t -83.14 -25.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.811 179.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -74.04 -28.1 61.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.51 -179.609 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -39.41 63.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.041 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.0 -25.75 48.18 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.165 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -46.59 64.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.949 0.404 . . . . 0.0 110.88 -179.86 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -71.79 -26.98 62.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.416 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -62.71 -59.18 5.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.031 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.437 HD12 HG21 ' A' ' 64' ' ' ILE . 38.1 mt -51.22 -28.13 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.289 179.957 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -29.76 68.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 -179.966 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -69.38 -38.44 78.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.097 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.414 ' CD1' ' CD2' ' A' ' 21' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.946 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.575 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.88 32.71 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.963 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 -142.3 -56.01 0.44 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.906 179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.33 -22.88 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.351 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -55.72 -38.48 69.8 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.19 -25.94 39.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.308 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.24 -27.28 68.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.062 -179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -74.3 -33.23 63.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.137 -179.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.19 -20.11 55.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.357 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.77 -43.13 38.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.333 -179.559 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.9 t -74.62 -29.06 22.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.706 -179.568 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -36.43 81.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.018 0.437 . . . . 0.0 110.352 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -23.85 37.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.548 0.689 . . . . 0.0 109.514 178.518 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.64 -25.06 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.054 179.527 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.407 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 54.0 tt0 -76.33 -50.63 13.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.309 -179.463 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -51.7 -26.18 8.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.783 0.325 . . . . 0.0 111.074 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -41.55 49.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.651 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 11.7 t -78.14 -51.81 17.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.19 -179.979 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.5 -31.6 10.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.464 -179.649 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.96 -10.84 37.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.52 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -69.46 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.823 0.344 . . . . 0.0 110.987 -179.932 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 137.45 -127.43 3.96 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.446 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -152.61 -177.94 26.75 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.538 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.61 -42.68 0.96 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.494 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 167.32 -65.58 0.19 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.437 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -37.53 77.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.897 0.38 . . . . 0.0 110.932 179.833 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 4.0 mt -71.19 -29.5 36.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.526 -179.74 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -62.25 -56.21 20.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.7 -179.363 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.1 -51.29 70.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.959 0.409 . . . . 0.0 111.466 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.42 ' HA ' HD13 ' A' ' 60' ' ' LEU . 96.1 mt -58.4 -21.09 49.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.122 -179.128 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -74.09 -59.04 2.91 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -178.965 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -45.41 62.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.927 -179.234 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.403 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.23 -24.93 61.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.024 -179.167 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.16 -57.86 9.13 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.694 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.21 81.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.936 -178.644 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -28.03 60.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.105 0.479 . . . . 0.0 110.889 179.997 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 tp -71.34 -41.7 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.287 -179.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.6 mttm -58.64 -58.3 9.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.675 -179.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.8 pttt -51.64 -27.77 12.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.685 -179.43 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 tttp -73.61 -25.8 60.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.459 -179.562 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.27 -39.11 34.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 111.239 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -63.92 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 179.666 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.499 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.46 -30.94 60.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.485 179.609 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.499 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 11.7 mt -60.12 172.36 0.82 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.988 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.64 -61.36 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.548 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 160.18 82.02 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.566 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -146.7 -125.3 1.64 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.445 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -108.18 -1.74 33.58 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.842 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -95.06 -23.39 17.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.799 0.333 . . . . 0.0 111.057 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -51.9 -30.27 12.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.373 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -29.12 65.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.082 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -68.87 -57.24 5.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.984 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 12.0 t -57.12 -26.91 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.084 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.34 -36.1 83.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -73.89 -27.92 61.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.768 179.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.44 -29.0 66.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 16.5 t -83.24 -25.71 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.066 179.935 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -75.11 -28.26 60.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -39.93 61.76 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.132 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.42 HD13 ' HA ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -78.17 -25.73 47.36 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -178.996 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -49.45 47.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.002 0.429 . . . . 0.0 110.644 -179.834 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.06 -26.68 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.099 179.855 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -62.0 -56.33 20.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 -179.632 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 25.7 mt -57.03 -25.87 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.264 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -62.58 -31.24 72.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.878 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -69.98 -60.97 1.97 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 1.6 pp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.026 179.991 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.651 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.54 58.42 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.962 0.41 . . . . 0.0 110.831 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -43.95 2.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -66.39 -34.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.112 179.962 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mttm -57.57 -33.93 68.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.688 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.79 -25.46 56.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.011 179.759 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.06 -29.14 66.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.09 -179.845 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.0 mt-10 -79.63 -39.91 30.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.276 -179.711 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -19.78 63.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.106 -179.946 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -46.75 67.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.069 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.3 t -71.89 -29.06 32.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.604 -179.711 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 -36.64 80.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.563 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.33 -24.53 37.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.589 0.709 . . . . 0.0 109.712 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.421 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.8 tt -65.9 -25.07 66.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.965 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.444 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -75.67 -41.05 54.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.388 -179.273 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -54.98 -28.12 49.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.307 -179.856 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -48.42 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.487 -179.688 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.644 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.7 t -69.71 -47.77 68.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.491 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 4.3 mtpm? -51.43 -28.76 13.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.232 -179.71 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.11 -10.95 37.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -159.69 0.07 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -116.65 -118.21 3.01 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.545 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 174.75 176.05 42.75 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.52 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.62 -28.29 2.55 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.53 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.47 -65.12 0.12 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.416 -179.998 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -62.11 1.95 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 110.942 179.872 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 7.2 mt -60.48 -29.76 45.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.524 -179.76 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -56.14 26.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.772 0.32 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.83 -30.83 67.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.974 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' CD2' ' HB3' ' A' ' 63' ' ' GLU . 3.4 mt -70.57 -21.8 62.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.385 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -78.6 -59.32 2.83 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -53.05 -36.72 60.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.776 0.322 . . . . 0.0 111.828 -179.041 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 7.4 ttpp -82.04 -24.99 35.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.991 -179.321 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.68 -57.81 8.86 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.532 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -42.29 84.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.528 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.89 -28.16 65.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.013 0.435 . . . . 0.0 110.995 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.9 tp -70.41 -47.0 62.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.52 -179.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -58.17 9.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 111.411 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -27.92 13.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.441 -179.714 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.3 tttp -69.87 -29.6 66.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.036 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.5 mt -75.11 -31.79 25.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.756 179.774 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -31.44 69.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.494 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.89 -29.9 58.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.574 179.667 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.48 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 7.4 mt -62.36 159.45 15.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.894 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.77 -77.16 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.49 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.69 161.51 28.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.88 -161.03 13.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.457 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -98.76 24.36 32.47 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.644 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -88.95 -27.09 21.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 111.024 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.4 t -55.63 -23.2 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.415 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.2 tttt -72.9 -32.47 65.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.943 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -65.93 -57.17 8.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.837 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 21.7 t -57.8 -28.05 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 179.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.67 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.945 0.402 . . . . 0.0 110.617 179.812 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -68.67 -27.86 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.784 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -70.26 -28.76 65.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.028 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 12.2 t -82.11 -25.81 9.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -75.18 -28.64 60.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.259 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -37.48 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.613 -179.229 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.469 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 4.2 tt -76.59 -27.69 55.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.405 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -56.18 11.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.051 0.453 . . . . 0.0 110.49 179.868 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -62.65 -26.87 68.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.821 179.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.503 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.91 -44.54 97.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.956 -179.92 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.4 ' CG1' HD23 ' A' ' 30' ' ' LEU . 13.9 mt -67.35 -24.26 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 110.885 179.505 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -33.87 76.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -62.32 -62.77 1.53 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.769 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.442 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 1.1 pp . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.644 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.6 t -114.71 103.37 10.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.817 -179.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.67 -31.51 69.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.927 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.6 t -69.41 -40.11 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.017 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -56.27 -32.61 64.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.708 179.919 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.88 -25.82 48.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.895 179.783 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -28.12 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.239 -179.961 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -77.2 -33.62 56.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.405 -179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.22 -24.58 59.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.104 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -70.42 -52.0 25.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 26.1 t -63.65 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -38.21 70.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.55 -28.85 46.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.544 0.688 . . . . 0.0 109.485 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.433 HD21 ' CD2' ' A' ' 60' ' ' LEU . 3.8 tt -59.75 -25.22 64.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.812 179.121 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.425 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.6 tt0 -77.73 -43.52 30.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.305 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -52.28 -30.98 30.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.179 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -76.06 -37.23 58.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.294 -179.835 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.643 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 20.2 t -78.1 -53.46 14.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.626 -179.594 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -49.77 -30.11 8.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.499 -179.468 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.8 -12.88 37.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.436 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.34 -69.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.014 -179.984 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 159.55 -95.73 0.14 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.484 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 150.35 135.24 2.37 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.501 179.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.47 117.69 2.43 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.483 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.94 -123.42 6.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.554 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -27.58 64.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 111.062 -179.981 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mt -70.74 -29.56 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.499 -179.597 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.07 -56.27 16.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.815 -179.156 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.73 -38.66 82.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.4 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 80.0 mt -67.78 -21.37 65.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.841 -179.369 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.08 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.59 -43.16 65.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 0.0 111.778 -179.279 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.403 ' CE ' HD13 ' A' ' 60' ' ' LEU . 7.1 ttpt -74.73 -24.95 58.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.908 -179.288 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -57.98 8.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.746 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.81 -51.33 34.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.814 -178.709 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.475 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.7 tt0 -50.86 -28.24 9.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.884 179.904 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 9.6 tp -70.26 -41.81 72.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.424 -179.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.07 -58.23 9.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.647 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -52.97 -27.77 20.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.347 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 3.7 tppp? -70.46 -25.67 63.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.71 -36.95 27.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 0.0 111.083 -179.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -67.95 -29.63 68.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.764 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -77.66 -29.95 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.15 0.5 . . . . 0.0 110.551 179.552 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.457 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.2 mt -53.47 162.34 0.82 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.152 -179.976 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -142.75 -102.98 0.45 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.455 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.94 -176.74 14.53 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.533 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -116.41 5.55 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.413 179.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.85 27.15 2.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -90.63 -28.08 18.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.1 -20.26 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.469 -179.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -32.16 64.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.215 -179.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.2 ttpp -67.95 -57.3 6.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 51.4 t -58.99 -25.98 31.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.044 179.959 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -37.99 88.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.504 179.798 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -71.31 -28.77 64.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.684 179.722 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.66 -28.89 66.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.912 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 18.7 t -83.06 -25.69 8.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.013 179.973 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -28.36 60.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.568 -179.606 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -38.73 58.11 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.078 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.433 ' CD2' HD21 ' A' ' 14' ' ' LEU . 1.0 OUTLIER -77.58 -25.55 50.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.256 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.13 -54.99 10.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.01 0.433 . . . . 0.0 110.509 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.8 -26.92 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.403 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.45 -59.11 5.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.17 -179.666 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.416 HG21 HD11 ' A' ' 64' ' ' ILE . 36.6 mt -52.73 -27.45 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.387 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -64.75 -29.87 70.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.916 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -75.08 -31.04 61.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.017 -179.925 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.894 179.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.643 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.134 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t -59.45 -26.98 65.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.803 0.335 . . . . 0.0 111.06 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.0 mmt85 -57.21 -57.27 13.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -73.49 -37.66 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.2 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 mttt -57.06 -32.93 66.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.06 -25.91 31.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.166 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.75 -27.79 68.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -78.67 -38.34 39.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.458 -179.452 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -19.86 62.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.534 -179.633 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -73.06 -53.7 10.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 -179.734 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 21.8 t -63.89 -29.31 46.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.72 -179.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -58.57 -37.06 74.95 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.727 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.22 -23.91 40.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.582 0.706 . . . . 0.0 109.463 178.73 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.408 HD21 ' CD2' ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.23 -25.22 67.59 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.946 179.36 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.407 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -74.24 -42.1 60.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.117 -179.38 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -56.81 -26.02 57.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.176 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -51.88 11.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.432 -179.768 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.648 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 8.5 t -68.12 -47.79 76.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.446 -179.697 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.5 mtpt -50.81 -27.16 6.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.327 -179.704 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.13 -10.86 37.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.533 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.19 -157.49 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.667 -179.832 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.33 135.99 3.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.47 -179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.02 95.75 1.98 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.556 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.57 179.16 16.94 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.507 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.53 -31.52 4.24 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.461 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -27.64 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.814 0.34 . . . . 0.0 111.023 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.8 mt -68.55 -29.67 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.459 -179.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.96 -56.15 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.64 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.18 -30.43 70.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 111.281 -179.497 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.425 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 95.0 mt -73.6 -21.35 60.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.491 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -78.06 -59.4 2.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.728 -179.345 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -33.59 59.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.793 0.33 . . . . 0.0 111.566 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -81.96 -24.89 35.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.813 -179.521 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -65.71 -58.05 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.766 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.9 -41.94 74.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.878 -178.832 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.5 -28.27 66.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.037 0.446 . . . . 0.0 110.789 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 tp -70.26 -40.75 74.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.461 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -61.72 -58.32 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.599 -179.462 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -50.59 -28.27 8.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.559 -179.601 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -69.79 -28.42 65.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.87 -179.995 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.3 mt -76.2 -30.26 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.586 179.579 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.89 -33.34 73.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.244 179.468 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.48 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -74.5 -30.61 61.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.342 179.61 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.48 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 13.3 mt -61.25 168.75 2.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.843 179.953 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -138.85 -95.53 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.545 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.29 -142.98 7.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.471 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -90.58 -175.97 44.44 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.562 179.914 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 101.76 -82.88 0.47 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.497 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -66.4 -15.04 62.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.634 0.254 . . . . 0.0 111.246 179.935 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.32 -18.85 12.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.625 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -74.65 -29.88 61.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.201 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -78.0 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.089 -179.782 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.1 t -57.23 -25.86 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.29 -179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.8 -35.17 79.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.392 . . . . 0.0 110.55 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -75.18 -27.67 59.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.739 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -69.29 -30.77 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.115 -179.827 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 9.6 t -83.3 -25.57 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.183 -179.958 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.98 -27.97 60.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.579 -179.524 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -76.06 -39.54 55.23 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -178.943 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -77.97 -25.26 48.03 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.273 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -52.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.05 0.452 . . . . 0.0 110.715 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -66.5 -26.92 67.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.225 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 1.4 tm-20 -61.89 -56.12 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 30.0 mt -56.15 -26.8 22.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.045 179.915 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -34.22 75.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.81 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.7 mmtt -67.2 -59.74 3.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.606 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 3.7 pp . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.019 179.819 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.648 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.415 -0.274 . . . . 0.0 112.415 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.3 t -128.8 -64.67 0.91 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -65.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.868 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.38 -29.46 47.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.217 179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -57.0 -35.78 69.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.958 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.04 -25.96 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.102 179.837 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 tt -62.67 -27.74 69.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.03 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -73.87 -32.99 63.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.17 -20.21 55.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.341 -179.84 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -51.13 48.05 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.894 0.378 . . . . 0.0 111.101 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 24.4 t -72.7 -29.19 29.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.44 -179.783 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -61.44 -36.57 80.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.406 179.985 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.26 -24.01 37.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.499 0.666 . . . . 0.0 109.56 178.623 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.01 -25.21 66.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.883 179.403 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -75.36 -47.78 26.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.221 -179.585 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -50.25 -28.23 7.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.157 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -76.11 -41.71 49.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.342 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.606 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.5 t -75.46 -55.08 12.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.422 -179.705 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -50.82 -29.33 11.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.357 -179.661 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.08 -11.68 35.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.4 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -68.49 -69.64 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.928 -179.965 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.39 -131.53 3.52 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.492 -179.965 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.53 136.28 6.61 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.437 -179.957 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.18 -171.52 43.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.556 179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -70.55 0.97 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.481 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.484 ' HG3' ' HA ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.1 -27.82 47.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 0.0 111.102 -179.913 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 71.4 mt -76.25 -29.58 19.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.291 -179.604 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -68.39 -45.76 71.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.184 -179.752 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -69.19 -29.35 67.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.389 . . . . 0.0 110.818 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 24.1 mt -74.53 -21.89 59.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.293 -179.841 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.65 -59.34 2.82 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.878 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -50.42 -56.85 9.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.647 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.406 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.1 OUTLIER -63.8 -24.99 67.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.18 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.44 -57.62 11.46 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.659 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.511 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.2 OUTLIER -68.96 -54.49 15.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.588 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.511 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.3 tt0 -47.78 -28.75 2.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.031 0.443 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 tp -69.81 -38.37 76.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.197 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -63.62 -58.2 7.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -50.66 -27.95 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.29 -179.854 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -70.56 -28.43 64.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.862 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.0 mt -74.07 -31.94 31.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.99 0.424 . . . . 0.0 110.58 179.614 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -67.86 -35.83 79.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.327 179.516 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -71.59 -29.37 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 179.568 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.457 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 13.1 mt -62.98 164.35 8.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.921 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -141.03 -99.8 0.39 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.566 -179.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -74.5 -93.97 0.13 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.587 179.989 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -136.95 -142.36 4.41 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.505 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.16 -88.87 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 -179.924 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -62.45 -26.18 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 179.976 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 25.1 t -54.89 -24.02 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.387 179.975 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -71.17 -29.44 65.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.013 -179.985 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.8 tptt -71.17 -57.26 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.89 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.0 t -55.49 -27.66 21.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.936 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.97 -31.84 73.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 110.649 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -79.55 -27.77 41.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -68.87 -28.73 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.319 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 20.9 t -83.1 -25.52 8.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.113 -179.892 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.15 -28.53 60.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.442 -179.66 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -40.46 52.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.742 -179.149 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.448 ' HG ' ' CD2' ' A' ' 30' ' ' LEU . 1.7 tt -76.2 -25.1 54.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.589 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -55.96 9.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.21 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.52 -26.79 68.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.464 ' HB3' ' CD2' ' A' ' 30' ' ' LEU . 0.3 OUTLIER -60.59 -50.01 75.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.992 -179.919 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 60' ' ' LEU . 14.2 mt -68.19 -22.79 27.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.784 179.452 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -38.74 67.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.383 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -93.91 -66.21 0.93 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.977 0.418 . . . . 0.0 110.733 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.484 ' HA ' ' HG3' ' A' ' 26' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.972 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.606 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.27 87.06 0.81 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.791 0.329 . . . . 0.0 110.903 -179.968 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.5 mtt180 -101.07 -60.39 1.53 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.958 -179.932 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.8 t -83.08 -50.54 15.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 -179.828 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -52.76 -30.48 32.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.892 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.55 -25.6 33.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.141 179.951 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.03 -29.13 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.391 -179.644 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -78.05 -33.48 50.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.556 -179.397 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -19.8 56.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.77 0.319 . . . . 0.0 111.67 -179.743 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -47.38 23.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.796 -179.166 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 18.6 t -74.79 -29.12 22.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.907 -179.264 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 ttpp -63.25 -36.25 83.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.324 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.52 -23.86 37.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.57 0.7 . . . . 0.0 109.753 178.722 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.4 ' CD2' ' CD2' ' A' ' 60' ' ' LEU . 1.6 tt -68.07 -25.12 65.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.211 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -75.0 -51.88 12.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.495 -179.4 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -50.2 -26.98 5.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.322 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -43.87 41.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.21 179.976 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.662 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 21.3 t -76.12 -48.12 29.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.556 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.59 -31.7 11.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.518 -179.552 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.13 -11.04 39.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.505 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.63 -69.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.99 -179.869 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 163.46 -109.02 0.36 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 159.19 123.88 0.73 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.93 136.84 3.45 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.49 179.961 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.35 -109.31 2.06 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.573 179.936 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -53.22 60.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.901 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 12.4 mt -60.21 -29.48 44.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.628 -179.473 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -59.09 -56.22 24.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.651 -179.265 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -58.45 -36.89 74.37 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.923 0.392 . . . . 0.0 111.225 -179.574 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 34' ' ' CYS . 6.5 mt -66.77 -21.79 66.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.887 -179.387 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 tttm -78.63 -59.54 2.74 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.831 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -37.41 56.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -178.921 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -82.25 -24.67 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.204 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.84 -57.81 7.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.494 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -40.85 77.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.67 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.5 tt0 -59.74 -27.78 66.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.13 0.49 . . . . 0.0 110.659 179.869 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.8 tp -75.81 -40.02 55.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.66 -179.234 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.81 -33.23 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.842 -179.311 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 4.2 ptmt -79.05 -30.45 44.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.058 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -63.28 -26.0 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.893 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.422 HG22 HD13 ' A' ' 41' ' ' ILE . 9.3 mt -73.55 -30.08 28.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.622 179.685 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.7 -35.63 75.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.435 179.519 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -71.71 -28.8 63.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.479 179.603 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.441 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 5.3 mt -57.66 -176.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.988 179.985 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.35 -126.35 1.93 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.535 179.995 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -68.88 -89.09 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.546 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.98 -167.82 11.67 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.47 179.945 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.41 -63.03 3.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.443 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -95.04 -23.31 17.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.4 p -54.16 -30.04 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.308 -179.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -33.46 74.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.061 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -57.29 12.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.864 -179.837 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 39.7 t -55.11 -26.08 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.109 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.78 -34.35 77.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.025 0.441 . . . . 0.0 110.373 179.588 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -76.3 -28.16 56.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.469 179.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.23 -28.76 68.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.881 179.826 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 4.5 t -81.81 -25.42 9.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.898 179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.7 -28.47 61.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.263 -179.852 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -74.51 -38.69 62.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.738 -179.373 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.452 ' O ' HG13 ' A' ' 64' ' ' ILE . 3.0 tt -76.58 -26.01 54.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.343 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.36 -56.26 9.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.01 0.433 . . . . 0.0 110.289 179.82 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -61.85 -26.64 68.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.36 179.242 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.413 ' CB ' ' CD2' ' A' ' 30' ' ' LEU . 3.2 mm-40 -61.16 -45.0 96.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 60' ' ' LEU . 14.8 mt -68.48 -23.76 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.023 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -34.34 76.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mtpm? -63.37 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.6 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.417 ' CD2' ' CD1' ' A' ' 30' ' ' LEU . 3.4 pp . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 101' ' ' HTS . . . . . 0.662 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.577 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.698 0.285 . . . . 0.0 111.627 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.01 -32.84 73.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.961 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -77.44 -19.96 55.25 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -50.14 19.09 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 57' ' ' VAL . 25.8 t -74.83 -29.26 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -36.57 81.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -24.22 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.535 0.683 . . . . 0.0 109.547 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.94 -25.11 66.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.954 179.507 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.423 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.9 tt0 -77.67 -44.46 27.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.168 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -52.31 -27.28 14.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -53.19 8.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.225 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.3 t -64.8 -52.03 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.312 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 12.1 mttt -52.23 -25.65 9.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.448 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.61 -11.04 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.408 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.444 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.526 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -27.75 65.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.776 0.322 . . . . 0.0 111.034 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.408 HG12 HD13 ' A' ' 21' ' ' LEU . 33.1 mt -72.73 -29.53 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.442 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -56.17 12.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.804 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.61 -35.98 77.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 111.483 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.666 ' O ' HD11 ' A' ' 60' ' ' LEU . 83.6 mt -71.1 -21.48 62.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.944 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -76.37 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 mttm -54.04 -43.04 69.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.352 . . . . 0.0 111.496 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -72.54 -25.11 61.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.695 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.85 -57.77 8.83 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.805 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.18 -49.15 62.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 33' ' ' LYS . 11.9 pt-20 -54.32 -28.55 43.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 0.0 110.989 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.049 HD21 HG22 ' A' ' 57' ' ' VAL . 8.1 tp -67.72 -41.98 82.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.064 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -58.21 9.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.287 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptpm? -51.11 -28.02 9.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.318 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -70.91 -25.9 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.577 HD13 HD22 ' A' ' 7' ' ' LEU . 6.8 mt -77.84 -30.54 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.824 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -67.45 -41.03 85.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.588 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.422 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.9 pt-20 -66.84 -35.42 80.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.513 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.763 HD11 ' CG2' ' A' ' 53' ' ' VAL . 10.9 mt . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.113 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.703 0.287 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 18.3 t -55.37 -22.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.504 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -72.33 -36.08 68.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.097 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -64.83 -57.41 8.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.961 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.763 ' CG2' HD11 ' A' ' 44' ' ' LEU . 28.0 t -57.96 -26.28 28.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.27 -37.32 87.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 110.414 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -71.85 -28.18 63.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.577 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -68.78 -29.46 67.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.872 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.049 HG22 HD21 ' A' ' 37' ' ' LEU . 19.7 t -83.25 -25.55 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.026 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -73.83 -28.26 61.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.522 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -75.37 -44.0 47.34 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.666 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.02 -25.12 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.01 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -70.43 -55.3 9.36 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.055 0.455 . . . . 0.0 110.752 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -62.22 -26.81 68.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.214 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -56.74 14.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.413 -179.5 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.569 HG12 HD13 ' A' ' 30' ' ' LEU . 21.5 mt -58.19 -24.57 24.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.345 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -31.76 58.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.515 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp . . . . . 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 111.364 -179.631 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.144 0 CA-C-O 120.739 0.304 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -61.51 -34.83 76.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.884 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.1 -19.57 56.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.722 0.296 . . . . 0.0 111.604 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.8 -44.51 63.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.671 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.578 HG22 ' CG1' ' A' ' 57' ' ' VAL . 19.3 t -79.1 -29.05 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.913 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -36.53 83.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.248 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.68 -26.66 34.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.545 0.688 . . . . 0.0 109.565 178.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.57 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -64.28 -25.15 67.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.09 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.403 ' HG2' ' CG ' ' A' ' 19' ' ' LYS . 1.2 tm-20 -76.85 -56.06 4.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.341 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.07 -27.91 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.491 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -76.03 -41.62 50.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.345 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 14' ' ' LEU . 22.1 t -76.13 -48.59 27.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.523 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.403 ' CG ' ' HG2' ' A' ' 15' ' ' GLU . 1.7 mtpt -49.16 -32.89 11.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.348 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -11.0 43.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.591 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.529 HD22 HG12 ' A' ' 27' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -60.28 3.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.906 0.384 . . . . 0.0 111.05 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.534 ' HA ' HD12 ' A' ' 30' ' ' LEU . 4.1 mt -55.0 -29.64 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.501 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -56.26 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.293 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.39 -28.95 63.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.9 0.381 . . . . 0.0 110.957 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.926 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.2 mt -74.54 -21.56 59.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.539 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.11 -59.2 2.88 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.05 -42.39 49.68 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -80.88 -25.21 37.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.901 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.19 -57.57 12.23 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.687 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.83 -55.73 15.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.459 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.501 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.4 tt0 -47.94 -28.39 2.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.039 0.447 . . . . 0.0 111.246 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.02 HD21 HG22 ' A' ' 57' ' ' VAL . 12.1 tp -71.41 -38.29 71.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.454 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HD2' HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -64.81 -58.28 6.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.536 -179.46 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -27.8 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.348 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 1.8 tptt -70.38 -25.58 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.239 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.63 -37.26 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.839 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.25 -29.71 69.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.779 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 4.4 pt-20 -78.4 -30.51 47.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.559 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.784 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.4 mt . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.037 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.784 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.1 tt0 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.755 0.312 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.509 ' HA ' HD13 ' A' ' 44' ' ' LEU . 14.9 p -52.85 -29.39 14.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.427 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.85 87.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.082 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -60.03 -57.09 14.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.066 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.616 ' CG2' HD11 ' A' ' 44' ' ' LEU . 24.4 t -55.79 -25.87 19.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.24 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.84 -37.84 87.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.35 . . . . 0.0 110.556 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.07 -27.98 63.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.795 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -70.61 -28.89 65.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.02 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.25 -25.56 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.054 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -28.64 60.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.4 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -39.67 54.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.926 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.5 tt -75.14 -25.25 58.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.481 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -56.1 8.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.951 0.405 . . . . 0.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.93 -26.96 67.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.869 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.2 mt-10 -61.66 -46.76 88.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 30' ' ' LEU . 17.2 mt -65.26 -24.2 34.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.01 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.31 -31.77 72.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.911 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 180.0 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.833 0.349 . . . . 0.0 111.117 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.501 ' CG ' HG21 ' A' ' 41' ' ' ILE . 20.8 mt-10 -81.93 -43.35 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.364 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -66.41 -19.87 65.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.423 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.67 -53.98 9.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.302 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.472 HG22 ' CG1' ' A' ' 57' ' ' VAL . 36.8 t -60.56 -29.23 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.723 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -37.23 74.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.8 40.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.47 0.653 . . . . 0.0 109.522 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 60' ' ' LEU . 1.3 tt -65.51 -25.12 67.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.915 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.4 tt0 -75.28 -46.43 33.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.098 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.22 -27.71 23.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -41.31 50.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.088 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.567 HG22 HD13 ' A' ' 64' ' ' ILE . 25.3 t -78.14 -51.78 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.579 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -49.82 -31.1 11.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.49 -179.559 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -11.59 38.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.464 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.579 HD22 HG12 ' A' ' 27' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.997 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 N-CA-C 112.611 -0.196 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -55.47 20.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.041 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.591 HD12 ' H ' ' A' ' 27' ' ' ILE . 4.6 mp -58.5 -29.67 39.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.717 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -56.21 21.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 0.0 111.299 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -26.82 64.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.191 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.884 HD23 ' HG ' ' A' ' 60' ' ' LEU . 5.6 mt -76.66 -21.68 55.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -78.56 -59.35 2.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -39.21 58.32 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.657 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -81.9 -24.96 35.39 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.07 -57.71 10.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.668 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -46.45 71.69 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -53.83 -28.17 34.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 0.0 110.835 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.107 HD21 HG22 ' A' ' 57' ' ' VAL . 8.7 tp -72.03 -41.78 67.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.388 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -58.18 9.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.538 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt -52.96 -28.54 24.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.351 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.414 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -69.15 -29.89 68.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.103 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.501 HG21 ' CG ' ' A' ' 8' ' ' GLU . 8.0 mt -74.47 -31.76 28.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.872 0.368 . . . . 0.0 110.671 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -68.83 -31.95 71.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.534 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -75.26 -29.65 60.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.679 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.559 HD22 HG22 ' A' ' 50' ' ' VAL . 6.1 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.969 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.63 0.252 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.559 HG22 HD22 ' A' ' 44' ' ' LEU . 21.2 t -51.53 -28.04 8.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.796 0.332 . . . . 0.0 111.454 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.74 -29.46 62.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.979 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -63.28 -57.17 11.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 34.5 t -61.12 -29.72 46.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.16 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -63.21 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.703 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -79.06 -27.67 43.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.895 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -69.27 -28.54 66.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.379 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.107 HG22 HD21 ' A' ' 37' ' ' LEU . 7.2 t -83.22 -25.87 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.116 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -75.23 -28.61 59.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -37.85 56.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.676 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.884 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.6 tt -76.93 -25.78 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.118 -0.233 . . . . 0.0 111.439 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.36 -56.08 9.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.988 0.423 . . . . 0.0 110.28 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -62.25 -26.78 68.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.776 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.852 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -60.27 -47.57 85.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.019 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.733 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.4 mt -66.37 -24.01 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.111 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -63.13 -33.99 76.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.717 179.896 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.48 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.146 0 CA-C-O 120.597 0.237 . . . . 0.0 111.496 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -83.06 -32.82 26.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.737 0.303 . . . . 0.0 111.404 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 12' ' ' LYS . 2.3 pp20? -76.2 -19.16 58.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.199 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.87 -46.97 14.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.009 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.64 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.9 t -72.51 -29.51 31.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 9' ' ' GLU . 18.1 ptpt -63.11 -35.42 80.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.934 0.397 . . . . 0.0 110.358 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.5 -23.76 37.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.496 0.665 . . . . 0.0 109.572 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 60' ' ' LEU . 2.4 tt -67.4 -25.22 65.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.004 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.9 tt0 -77.2 -48.47 17.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.247 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.38 -25.88 10.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.188 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -76.06 -45.2 35.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.633 HG22 HD13 ' A' ' 64' ' ' ILE . 2.3 t -75.77 -51.04 21.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.458 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 16.3 mttt -52.2 -30.43 27.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.26 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.0 -11.45 35.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.287 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 112.836 -0.105 . . . . 0.0 112.836 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -27.91 11.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 111.289 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.419 ' HA ' HD12 ' A' ' 30' ' ' LEU . 59.9 mt -64.59 -29.82 48.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.167 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -59.75 -56.02 26.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.338 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.42 -36.72 71.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 0.0 111.282 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.962 HD23 ' HG ' ' A' ' 60' ' ' LEU . 7.1 mt -67.1 -21.86 65.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.643 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -78.54 -59.1 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -51.89 -59.09 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.816 0.341 . . . . 0.0 111.914 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.451 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -59.92 -24.99 64.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.698 -179.458 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.03 -57.75 11.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -67.25 -55.47 13.86 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.561 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.8 OUTLIER -47.98 -28.27 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 0.0 111.18 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 57' ' ' VAL . 10.8 tp -70.51 -41.33 72.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.342 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -58.27 9.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.548 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 10.8 ptmt -52.46 -27.98 18.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.242 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -71.07 -25.82 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.053 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.7 mt -74.07 -31.85 31.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.862 0.363 . . . . 0.0 110.67 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -67.95 -33.56 74.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.335 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -74.66 -28.59 60.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.737 179.612 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB ' ' A' ' 53' ' ' VAL . 7.8 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.108 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.728 0.299 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 p -49.46 -27.19 2.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.691 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -26.06 61.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.414 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -77.96 -57.39 3.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.206 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.622 ' O ' HG23 ' A' ' 57' ' ' VAL . 22.3 t -57.5 -25.89 25.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.325 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -38.03 86.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 110.652 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.03 -27.79 62.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -72.06 -28.7 63.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.438 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.23 -27.35 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.224 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -28.71 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.76 -39.08 52.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.939 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.962 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -78.14 -24.94 47.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.632 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -70.43 -54.27 13.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.985 0.422 . . . . 0.0 110.205 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -64.03 -26.85 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.635 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.917 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.6 mm-40 -59.37 -57.7 11.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.834 ' CG1' HD22 ' A' ' 30' ' ' LEU . 29.6 mt -56.14 -25.6 20.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.24 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -28.09 65.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.017 -179.898 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.47 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.761 0.315 . . . . 0.0 111.213 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -68.08 -34.14 75.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.295 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -77.06 -19.79 56.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.409 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -42.74 67.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.346 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.442 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.1 t -78.4 -29.31 14.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.6 81.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.043 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.9 37.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.539 0.685 . . . . 0.0 109.59 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.596 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -66.99 -25.33 66.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.905 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.13 -50.7 11.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.091 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -49.42 -27.46 4.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.135 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -76.04 -40.54 53.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.907 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.627 HG22 HD13 ' A' ' 64' ' ' ILE . 16.0 t -78.32 -55.3 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -55.2 -22.08 16.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.64 -16.09 27.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.408 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.581 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp . . . . . 0 C--N 1.332 -0.189 0 CA-C-O 120.89 0.376 . . . . 0.0 110.817 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.568 -0.213 . . . . 0.0 112.568 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -27.76 64.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 111.018 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.4 mt -68.06 -29.8 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.219 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.51 -56.12 21.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.178 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.57 -29.51 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.837 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.001 HD21 ' HB3' ' A' ' 63' ' ' GLU . 9.5 mt -72.08 -22.28 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.325 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -78.61 -59.16 2.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -58.87 5.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.794 0.331 . . . . 0.0 111.838 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.744 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.5 ttpm? -60.37 -25.05 65.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.75 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.38 -57.57 11.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.639 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.36 -55.44 10.4 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.546 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.01 -28.62 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.006 0.431 . . . . 0.0 111.141 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.109 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.02 -38.24 75.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.165 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -58.02 8.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.375 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptmt -50.25 -31.78 14.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.378 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.407 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 38.2 tttp -66.76 -25.98 66.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 mt -74.13 -32.41 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 0.0 110.625 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -67.35 -36.34 81.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -71.02 -29.78 65.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.483 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.671 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.1 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HB3' HD21 ' A' ' 44' ' ' LEU . 7.8 tt0 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.794 0.331 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.3 p -50.1 -28.33 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.53 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.62 -31.55 67.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.068 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -66.42 -57.25 7.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.671 ' CG2' HD11 ' A' ' 44' ' ' LEU . 18.0 t -58.99 -25.9 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.126 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -38.36 89.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -71.71 -27.88 63.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.638 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -69.75 -28.94 66.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.928 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.109 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.49 -25.45 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.046 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -74.58 -28.38 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.437 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.61 -43.44 48.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.503 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.937 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -72.51 -25.04 61.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.59 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -69.76 -56.14 7.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.936 0.398 . . . . 0.0 110.557 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.49 -26.94 65.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.807 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 1.001 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.32 -48.41 78.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.943 -179.925 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.671 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.6 mt -65.75 -24.16 33.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.861 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -35.33 76.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.989 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.899 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.917 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.757 0.313 . . . . 0.0 111.283 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.521 ' HG3' HG21 ' A' ' 41' ' ' ILE . 58.1 mt-10 -78.68 -32.57 47.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.639 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -20.47 56.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -74.81 -55.04 6.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.897 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.705 HG22 HG13 ' A' ' 57' ' ' VAL . 12.1 t -63.91 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.267 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -59.23 -36.84 76.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.438 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.407 ' HB1' ' OE2' ' A' ' 16' ' ' GLU . . . -78.95 -23.89 44.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.531 0.682 . . . . 0.0 109.414 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.599 HD21 HD23 ' A' ' 60' ' ' LEU . 2.3 tt -66.85 -24.99 66.2 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.856 -1.066 . . . . 0.0 110.86 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.428 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 34.3 tt0 -74.19 -49.77 22.11 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.63 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.407 ' OE2' ' HB1' ' A' ' 13' ' ' ALA . 1.1 pt-20 -50.71 -26.02 5.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.757 0.313 . . . . 0.0 111.341 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -75.11 -43.91 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.173 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.46 HG22 HD13 ' A' ' 64' ' ' ILE . 3.0 t -77.94 -56.26 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.334 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 22.2 mttt -51.82 -24.11 5.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.301 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.52 -18.81 28.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.142 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.585 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.808 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.4 ' HD3' HG13 ' A' ' 27' ' ' ILE . 0.2 OUTLIER -56.56 -27.63 58.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.104 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.409 HD13 ' CD1' ' A' ' 21' ' ' LEU . 61.4 mt -74.19 -29.69 25.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.502 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -56.15 15.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.759 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -61.19 -37.58 83.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.625 HD21 ' HB3' ' A' ' 63' ' ' GLU . 71.5 mt -67.54 -21.41 65.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.801 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -78.03 -59.29 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -53.59 -34.8 59.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.748 0.308 . . . . 0.0 111.777 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.02 -24.78 35.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.823 -179.404 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.96 -58.0 8.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -46.4 68.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.876 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -55.05 -28.17 50.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.057 0.456 . . . . 0.0 110.789 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.981 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.33 -42.44 75.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.328 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -58.17 9.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.4 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -49.97 -32.8 15.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.444 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -66.46 -26.84 67.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.521 HG21 ' HG3' ' A' ' 8' ' ' GLU . 8.4 mt -74.81 -32.39 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.569 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.65 -33.18 74.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.413 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.42 -29.79 61.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.509 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.581 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.8 mt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 . . . . . 0 CA--C 1.527 0.089 0 CA-C-O 120.699 0.285 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.74 -29.56 7.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.482 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -66.17 -31.0 71.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.029 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.2 tptp -66.33 -57.25 7.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.588 ' O ' HG23 ' A' ' 57' ' ' VAL . 44.8 t -55.49 -26.01 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.202 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.93 -36.58 84.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.57 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -73.79 -27.84 61.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.723 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -69.53 -28.69 66.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.981 HG22 HD21 ' A' ' 37' ' ' LEU . 10.2 t -82.76 -25.71 8.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.115 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.35 -28.38 59.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.597 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.08 -41.19 62.08 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.12 -26.17 47.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.942 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -71.54 -42.22 68.17 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.962 0.41 . . . . 0.0 110.735 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 65' ' ' LYS . 4.4 tt0 -74.26 -26.38 60.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.625 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -64.38 -59.2 4.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.405 -179.531 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.46 HD13 HG22 ' A' ' 18' ' ' VAL . 37.9 mt -51.29 -26.58 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.044 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 2.4 mptp? -52.9 -38.72 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.408 179.529 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.737 0.303 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -74.48 -30.4 61.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.496 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.01 -24.77 52.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -52.5 38.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.813 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.626 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.3 t -67.06 -29.21 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.351 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.06 75.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.78 -24.48 38.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 109.56 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.585 HD21 HD23 ' A' ' 60' ' ' LEU . 1.9 tt -64.99 -24.94 67.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.941 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.422 ' HG2' ' HG3' ' A' ' 19' ' ' LYS . 0.6 OUTLIER -77.38 -55.34 5.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.607 -179.122 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -46.8 -27.72 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.513 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -76.1 -40.5 52.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.313 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.465 HG22 HD13 ' A' ' 64' ' ' ILE . 13.1 t -78.19 -45.48 26.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.484 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG3' ' HG2' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -49.22 -29.91 6.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.495 -179.413 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.55 -13.23 37.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.472 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.507 HD22 HD13 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.978 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 N-CA-C 112.519 -0.232 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.591 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.96 -28.13 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 0.0 110.771 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 30' ' ' LEU . 12.5 mt -67.78 -29.72 46.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.243 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -52.78 60.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.108 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -57.64 -30.39 65.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.923 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.979 HD23 ' HG ' ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.5 -21.86 61.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.306 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -78.09 -59.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.998 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.75 69.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.823 0.344 . . . . 0.0 111.809 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.576 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -71.55 -24.94 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.809 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.93 -57.96 8.99 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.631 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -47.07 66.87 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -28.09 49.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.096 0.474 . . . . 0.0 110.844 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.046 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -72.92 -39.0 66.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.431 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -53.08 62.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.451 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -27.99 68.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.384 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 6.5 tptm -67.09 -27.14 67.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.281 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.47 -33.59 23.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.881 0.372 . . . . 0.0 110.666 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.45 -31.46 72.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.21 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -77.11 -29.41 54.81 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.441 179.644 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.701 HD11 ' CG2' ' A' ' 53' ' ' VAL . 23.6 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.002 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.705 0.288 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.497 HG13 HD13 ' A' ' 44' ' ' LEU . 29.3 t -53.34 -27.89 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.396 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -28.54 67.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.044 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.25 -57.17 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.936 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.701 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.5 t -52.47 -27.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.481 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -63.27 -30.99 72.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.983 0.421 . . . . 0.0 110.687 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -80.97 -27.83 35.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.831 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -67.95 -28.72 67.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.046 HG22 HD21 ' A' ' 37' ' ' LEU . 21.2 t -81.05 -25.84 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.969 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.01 -28.42 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.332 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.25 -37.15 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.979 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.0 tt -76.08 -28.67 57.67 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.087 -0.245 . . . . 0.0 111.393 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.5 -56.13 12.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.917 0.389 . . . . 0.0 110.652 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -62.26 -26.79 68.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.841 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.854 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -61.82 -43.19 99.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.028 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.893 HG12 HD22 ' A' ' 30' ' ' LEU . 17.5 mt -65.72 -24.53 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.208 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.1 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.888 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.831 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.035 HD21 HG21 ' A' ' 57' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.44 -33.11 66.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.381 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -19.6 56.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.534 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.12 -43.2 24.55 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.633 HG22 ' CG1' ' A' ' 57' ' ' VAL . 17.6 t -76.91 -29.39 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -63.07 -35.24 79.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.973 0.416 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.28 -26.76 35.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.606 0.717 . . . . 0.0 109.503 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' HG23 ' A' ' 18' ' ' VAL . 2.7 tt -63.15 -25.46 68.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.814 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.406 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.6 tt0 -76.86 -45.11 29.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.196 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.43 -29.03 22.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.143 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -45.95 30.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.593 HG22 HD13 ' A' ' 64' ' ' ILE . 2.9 t -70.87 -51.57 34.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.527 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -50.33 -31.01 13.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.364 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.2 -13.33 38.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.387 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.868 HD22 HD11 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.49 -62.03 2.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.868 HD11 HD22 ' A' ' 21' ' ' LEU . 10.6 mt -51.04 -29.15 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.952 -179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -60.04 -56.35 22.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -56.61 19.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.979 0.419 . . . . 0.0 111.365 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.936 HD13 HG12 ' A' ' 64' ' ' ILE . 37.5 mt -53.01 -21.02 3.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.467 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.9 -59.25 2.86 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -39.15 58.64 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.749 ' HD3' HD12 ' A' ' 60' ' ' LEU . 34.7 tttp -80.77 -24.67 38.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.282 -0.417 . . . . 0.0 112.12 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.3 -57.77 9.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.649 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -47.76 66.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.036 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.43 -28.19 42.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.064 0.459 . . . . 0.0 110.973 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.014 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.39 -41.71 72.66 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.313 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -58.98 -58.08 10.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.352 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.31 -28.02 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.41 -26.31 63.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.033 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -74.22 -32.55 32.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.969 0.414 . . . . 0.0 110.628 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.61 -33.98 76.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.515 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -73.72 -29.26 62.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.646 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.737 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.2 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.979 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.701 0.286 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -48.91 -30.64 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.447 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -29.9 65.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.917 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -66.71 -57.19 7.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.878 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.737 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.6 t -56.57 -29.51 29.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.141 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.645 ' HA ' HD11 ' A' ' 7' ' ' LEU . 19.6 tt0 -62.25 -33.59 74.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.623 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -76.85 -28.01 55.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.786 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -67.58 -28.82 68.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.965 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.035 HG21 HD21 ' A' ' 7' ' ' LEU . 11.9 t -83.03 -25.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.998 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -74.11 -28.21 61.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.486 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.54 -41.45 54.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.749 HD12 ' HD3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -76.91 -25.73 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.505 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.45 -53.96 14.26 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.991 0.424 . . . . 0.0 110.628 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -64.39 -26.89 68.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.185 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.4 mm-40 -61.9 -59.08 5.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.258 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.936 HG12 HD13 ' A' ' 30' ' ' LEU . 33.5 mt -54.28 -25.45 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.667 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -53.0 -38.64 62.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.724 0.297 . . . . 0.0 111.438 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.6 mttp . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.864 0.364 . . . . 0.0 110.951 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.754 0.312 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -72.44 -31.34 65.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.596 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.25 -21.92 52.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.725 0.298 . . . . 0.0 111.378 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -54.98 9.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.235 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 57' ' ' VAL . 22.7 t -67.76 -29.21 44.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.419 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -59.5 -36.65 76.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.634 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.03 -23.99 38.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.6 0.714 . . . . 0.0 109.541 178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.567 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.24 -25.23 67.58 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.819 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HG3' ' HG3' ' A' ' 19' ' ' LYS . 26.9 tt0 -75.84 -46.02 32.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.012 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -53.17 -27.1 19.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.207 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -49.19 18.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.413 HG22 HD13 ' A' ' 64' ' ' ILE . 18.7 t -70.08 -55.2 15.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.376 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 6.2 mtpt -52.67 -24.53 8.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.492 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.92 -19.12 26.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.897 HD12 HG21 ' A' ' 27' ' ' ILE . 1.6 tm? . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.248 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -61.41 2.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.014 0.435 . . . . 0.0 110.922 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.897 HG21 HD12 ' A' ' 21' ' ' LEU . 2.0 mp -51.75 -29.46 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.911 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -56.18 25.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.49 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.422 . . . . 0.0 110.962 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.933 HD22 ' CG1' ' A' ' 64' ' ' ILE . 2.4 mt -69.2 -21.27 63.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.618 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -77.72 -59.19 2.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -54.1 32.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.352 . . . . 0.0 111.583 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 9.3 tttp -65.1 -25.07 67.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.784 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.5 -57.53 12.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.08 -52.34 43.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.609 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.46 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.8 tm-20 -49.49 -28.38 5.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 111.106 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.03 HD21 HG22 ' A' ' 57' ' ' VAL . 9.7 tp -71.87 -41.89 67.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.58 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -58.29 9.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.707 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -33.02 9.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.636 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 tttt -67.85 -27.19 66.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.165 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -76.0 -31.49 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.868 0.366 . . . . 0.0 110.752 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -69.69 -31.41 69.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.6 pt-20 -76.05 -29.6 58.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.529 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 50' ' ' VAL . 8.3 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.768 0.318 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.617 HG23 HD13 ' A' ' 44' ' ' LEU . 14.7 p -54.35 -28.73 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.351 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -66.06 -32.84 74.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.153 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -69.69 -57.34 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.994 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.4 t -52.87 -25.81 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.432 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -65.87 -38.06 87.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.719 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -72.06 -27.78 62.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.84 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.84 -29.11 65.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.136 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.03 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.28 -25.85 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.116 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -75.31 -28.5 59.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.51 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -38.59 55.91 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.929 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.0 -25.34 47.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.616 0.246 . . . . 0.0 111.627 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -54.18 15.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.065 0.459 . . . . 0.0 110.466 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 -26.84 68.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.923 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.85 -51.19 70.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.166 -179.746 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.933 ' CG1' HD22 ' A' ' 30' ' ' LEU . 19.4 mt -62.03 -24.64 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.114 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -66.07 -31.87 73.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.969 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.6 mttm . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.894 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.659 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.789 0.328 . . . . 0.0 111.168 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -78.73 -39.98 34.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.323 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -19.97 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.381 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -53.76 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.192 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.579 HG22 ' CG1' ' A' ' 57' ' ' VAL . 31.6 t -64.31 -29.31 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.41 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -37.1 75.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.729 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 -23.93 41.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.511 0.672 . . . . 0.0 109.517 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.677 HD21 HD23 ' A' ' 60' ' ' LEU . 2.2 tt -65.22 -25.28 67.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.707 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.409 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 41.9 tt0 -79.09 -47.4 16.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -51.36 -30.64 19.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.899 0.381 . . . . 0.0 111.082 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.4 tttm -76.15 -38.04 57.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 14' ' ' LEU . 20.0 t -78.12 -56.26 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.399 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.7 mtpp -52.74 -24.62 9.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.243 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -18.75 26.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.98 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.629 HD11 HG12 ' A' ' 27' ' ' ILE . 1.2 pp . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -37.27 72.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.864 0.364 . . . . 0.0 110.913 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.629 HG12 HD11 ' A' ' 21' ' ' LEU . 19.7 mt -63.41 -29.73 47.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.867 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.92 -56.18 17.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.628 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -27.09 67.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 63' ' ' GLU . 96.5 mt -76.83 -21.54 54.89 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.552 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -78.33 -59.35 2.82 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -53.34 -36.24 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 111.727 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.77 35.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.842 -179.265 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.8 -57.71 9.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -44.94 72.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.885 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 52.9 tt0 -55.34 -28.04 51.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.161 0.505 . . . . 0.0 110.776 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 6.1 tp -70.97 -42.2 70.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.337 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -57.96 -58.19 9.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.537 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 7.1 pttt -51.69 -28.36 14.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -70.74 -26.9 63.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.013 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.546 ' HA ' HD12 ' A' ' 44' ' ' LEU . 6.9 mt -77.73 -29.56 16.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.867 0.365 . . . . 0.0 110.749 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -38.98 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.423 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.434 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.7 pt-20 -68.17 -35.21 77.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.347 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.858 HD11 HG21 ' A' ' 53' ' ' VAL . 7.0 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.024 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.598 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 4.8 tt0 . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.62 0.247 . . . . 0.0 111.533 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.78 -14.69 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.706 0.288 . . . . 0.0 111.234 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -52.92 11.43 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.598 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -54.81 -57.2 12.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 44' ' ' LEU . 16.5 t -55.66 -31.31 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.806 0.336 . . . . 0.0 111.246 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.659 ' HG2' HD11 ' A' ' 7' ' ' LEU . 2.1 tm-20 -61.95 -32.7 73.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -77.37 -27.74 52.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.841 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.02 -29.94 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 14.5 t -83.31 -25.56 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.179 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -28.18 61.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.376 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -37.83 59.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.757 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.677 HD23 HD21 ' A' ' 14' ' ' LEU . 1.1 tt -78.09 -25.7 47.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.759 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.29 -55.53 8.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 110.496 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.28 -26.89 68.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.919 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.865 ' HB3' HD21 ' A' ' 30' ' ' LEU . 5.1 mt-10 -62.58 -49.35 75.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.464 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.793 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -58.21 -27.75 33.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.075 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -67.35 -30.35 70.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.898 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.959 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.726 0.298 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -74.53 -33.43 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.548 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.94 -19.72 57.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.21 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -42.79 47.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.143 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.9 t -74.12 -29.42 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.379 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -62.08 -36.02 80.41 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.347 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.22 -24.49 37.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.463 0.649 . . . . 0.0 109.54 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.55 HD21 HD23 ' A' ' 60' ' ' LEU . 1.4 tt -65.74 -25.24 67.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.745 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 35.6 tt0 -74.17 -40.31 62.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.167 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -53.63 -28.61 33.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.196 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 tptt -76.06 -43.8 42.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.754 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.4 t -73.97 -52.56 20.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.373 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.3 mttm -49.12 -31.71 8.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.321 . . . . 0.0 111.577 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.14 -12.28 61.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.297 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.26 -27.8 4.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.72 0.295 . . . . 0.0 111.229 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.697 HG21 ' HG ' ' A' ' 21' ' ' LEU . 55.6 mt -65.01 -29.95 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.441 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -62.22 -56.06 22.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -58.84 -27.0 64.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.894 0.378 . . . . 0.0 110.836 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.985 HD21 ' HB3' ' A' ' 63' ' ' GLU . 4.9 mt -73.71 -23.4 59.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.292 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -78.32 -59.43 2.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -36.98 45.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.671 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.93 35.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.022 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.43 -57.85 8.1 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -178.57 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -43.51 73.8 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.594 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.29 -28.2 64.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.029 0.442 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.139 HD21 HG22 ' A' ' 57' ' ' VAL . 6.4 tp -69.13 -48.3 62.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.458 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -58.25 8.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.532 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -29.03 30.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.399 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 28.4 tttm -70.04 -26.25 63.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.2 mt -76.76 -32.34 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 0.0 110.712 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -69.0 -32.57 72.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.443 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.479 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.32 -29.97 60.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.518 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.73 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.2 mt . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.963 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.632 0.253 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.1 t -56.0 -21.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.609 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -75.61 -25.95 57.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -78.01 -57.31 3.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.108 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.73 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.8 t -57.45 -29.8 34.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.369 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -38.57 90.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 110.649 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.69 -27.68 63.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.862 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.59 -29.28 66.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.307 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.139 HG22 HD21 ' A' ' 37' ' ' LEU . 15.4 t -83.21 -25.77 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.919 0.39 . . . . 0.0 111.187 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.84 -28.31 60.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.275 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmt? -75.16 -41.01 59.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.76 -179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.925 ' HG ' HD23 ' A' ' 30' ' ' LEU . 2.1 tt -73.59 -27.64 61.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.642 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.58 -56.04 11.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.885 0.374 . . . . 0.0 110.789 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 65' ' ' LYS . 6.3 tt0 -61.11 -26.93 68.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.985 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.91 -49.38 75.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.389 -179.485 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.581 ' CG1' HD22 ' A' ' 30' ' ' LEU . 16.8 mt -63.82 -24.46 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.755 0.312 . . . . 0.0 111.313 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 49.7 mmtt -55.99 -37.66 69.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.131 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.699 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.771 0.319 . . . . 0.0 111.007 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -73.33 -33.35 65.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.078 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -77.2 -20.01 55.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.302 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -45.63 65.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.255 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.489 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.9 t -75.91 -29.42 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.475 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -35.86 81.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.979 0.419 . . . . 0.0 110.173 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -24.06 37.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.515 0.674 . . . . 0.0 109.467 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.613 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER -66.05 -25.15 66.92 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.915 179.426 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.85 -56.13 4.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.365 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -47.04 -29.52 2.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.366 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -76.04 -39.53 55.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.003 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 14' ' ' LEU . 25.0 t -78.09 -51.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.326 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -51.21 -29.87 15.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.408 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.93 -11.78 35.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.327 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.868 0.366 . . . . 0.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.524 ' O ' HD12 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -56.88 -27.77 60.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 111.02 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -70.14 -29.66 40.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.282 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -56.09 22.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.75 68.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.91 HD23 ' HG ' ' A' ' 60' ' ' LEU . 9.3 mt -71.16 -21.62 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.612 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -78.53 -58.97 2.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.08 -59.04 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.641 ' NZ ' HD12 ' A' ' 60' ' ' LEU . 4.1 ttpm? -61.22 -25.06 66.8 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.936 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.21 -57.63 11.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.842 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.34 -55.41 16.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.511 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 33.7 tt0 -48.47 -28.51 3.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.983 0.421 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.1 HD21 HG22 ' A' ' 57' ' ' VAL . 10.9 tp -70.32 -42.63 71.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.805 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -58.49 6.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 111.739 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.23 -27.94 10.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.513 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.43 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 7.9 ttpt -70.73 -28.22 64.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.093 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.14 -32.76 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.659 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.09 -33.38 74.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.344 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.4 pt-20 -73.98 -29.73 62.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 HG22 ' A' ' 50' ' ' VAL . 9.8 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.009 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.425 ' CD ' HD21 ' A' ' 44' ' ' LEU . 3.4 tt0 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.779 0.324 . . . . 0.0 111.002 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.6 HG22 HD13 ' A' ' 44' ' ' LEU . 21.7 t -59.28 -19.66 16.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.519 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -70.65 -35.06 72.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -73.56 -57.15 4.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.545 ' O ' HG23 ' A' ' 57' ' ' VAL . 38.7 t -53.14 -25.96 10.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.309 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -35.83 82.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.609 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -74.54 -27.88 60.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.73 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -70.12 -28.73 65.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.1 HG22 HD21 ' A' ' 37' ' ' LEU . 15.9 t -83.1 -25.83 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -75.27 -28.42 59.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.533 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -76.06 -38.56 56.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.91 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.18 -25.09 47.0 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.598 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -54.18 15.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.001 0.429 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -64.76 -26.83 68.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.651 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.903 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -58.78 -56.2 25.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.9 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.699 ' CG1' HD22 ' A' ' 30' ' ' LEU . 23.5 mt -59.15 -24.5 27.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.187 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -31.54 72.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.88 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 mttm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 179.972 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.495 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HG3' HG21 ' A' ' 41' ' ' ILE . 53.2 mt-10 -75.12 -32.54 61.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.243 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -77.19 -20.68 55.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.245 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -68.86 -51.0 45.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.016 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.682 HG22 ' CG1' ' A' ' 57' ' ' VAL . 14.7 t -71.57 -29.14 33.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.492 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.9 ttpt -60.86 -36.38 79.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.441 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.1 -24.67 37.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.409 0.623 . . . . 0.0 109.559 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.49 -25.4 67.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.892 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.7 tt0 -77.71 -47.76 18.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.25 -29.57 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.319 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -76.14 -40.01 53.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 10.1 t -78.01 -59.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.997 0.427 . . . . 0.0 111.235 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -51.49 -22.82 3.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.99 -18.28 29.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.379 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.834 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.911 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.569 -0.212 . . . . 0.0 112.569 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -54.67 -62.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.111 0.481 . . . . 0.0 110.842 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.834 HG21 HD11 ' A' ' 21' ' ' LEU . 4.9 mt -55.42 -29.55 24.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.803 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -56.24 20.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.666 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.16 -41.12 87.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.991 0.424 . . . . 0.0 110.853 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.932 HD23 ' HG ' ' A' ' 60' ' ' LEU . 2.9 mt -59.41 -21.13 59.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.702 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.4 -59.0 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -59.05 4.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.886 0.374 . . . . 0.0 111.691 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HZ3' HD12 ' A' ' 60' ' ' LEU . 1.3 ttpt -61.21 -24.86 66.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.845 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.38 -57.5 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.908 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.34 -54.63 16.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -178.471 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.52 -28.3 3.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.02 0.438 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.041 HD21 HG22 ' A' ' 57' ' ' VAL . 9.0 tp -69.13 -41.48 77.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.468 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -58.26 8.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.44 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -52.02 -27.93 15.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.409 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.25 -29.07 67.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.047 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.402 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.7 mt -75.2 -32.59 26.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 0.0 110.602 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -31.3 71.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.394 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.1 OUTLIER -76.37 -29.93 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.473 179.673 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.652 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.4 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.976 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.748 0.308 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.617 HG22 HD22 ' A' ' 44' ' ' LEU . 21.8 t -56.01 -26.3 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -62.93 -32.15 73.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.054 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.17 -57.19 13.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.85 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.652 ' CG2' HD11 ' A' ' 44' ' ' LEU . 22.9 t -57.46 -25.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.209 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.17 -32.92 74.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -27.85 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -70.08 -28.72 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.041 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.22 -25.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.062 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -28.63 59.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.587 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.24 -37.77 57.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.142 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.932 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.4 tt -78.04 -25.24 47.71 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.581 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -55.44 10.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.051 0.453 . . . . 0.0 110.268 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -63.56 -26.88 68.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.813 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.93 ' HB3' HD21 ' A' ' 30' ' ' LEU . 11.9 mm-40 -60.11 -50.99 71.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.976 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.901 ' CG1' HD22 ' A' ' 30' ' ' LEU . 22.1 mt -61.74 -24.18 33.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.17 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -30.66 71.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.023 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 28.7 mttt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.908 179.86 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.52 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.831 0.348 . . . . 0.0 111.224 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.56 -31.21 53.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.549 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.15 -22.4 52.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.714 0.292 . . . . 0.0 111.254 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -54.36 8.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 HG13 ' A' ' 57' ' ' VAL . 25.1 t -65.79 -29.41 46.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.492 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -59.03 -36.78 75.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.68 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.28 -23.97 40.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.488 0.661 . . . . 0.0 109.336 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.07 -25.25 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.82 179.316 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 54.4 tt0 -78.34 -41.98 31.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.212 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -55.14 -30.98 60.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.031 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.469 ' HD3' HG21 ' A' ' 64' ' ' ILE . 10.8 tttm -76.08 -42.84 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.25 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' LEU . 2.9 t -73.43 -52.55 21.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.475 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.6 mttt -50.01 -31.07 11.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.22 -10.89 36.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.36 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.936 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -44.01 86.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.506 HG12 HD13 ' A' ' 21' ' ' LEU . 7.5 mt -64.94 -29.57 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.58 -56.35 23.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.708 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.68 -47.02 85.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.933 0.397 . . . . 0.0 111.182 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.889 HD13 HG12 ' A' ' 64' ' ' ILE . 76.4 mt -57.87 -21.06 41.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.86 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -74.51 -59.1 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -50.9 -46.81 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.76 -24.66 60.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.095 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.07 -57.78 9.5 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.585 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -70.29 -52.45 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.767 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.484 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.2 tm-20 -50.18 -28.2 7.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.159 0.504 . . . . 0.0 110.937 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.048 HD21 HG22 ' A' ' 57' ' ' VAL . 8.5 tp -69.86 -43.68 71.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.224 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.81 -58.29 9.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.314 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -52.62 -27.9 19.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.331 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 -25.78 63.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.216 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.2 mt -79.35 -32.81 15.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 111.042 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -66.65 -38.73 87.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.738 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -70.33 -37.54 74.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.826 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.2 mt . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.049 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.728 0.299 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -49.06 -29.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.519 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -71.98 -29.44 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -69.12 -57.34 5.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.069 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.826 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.6 t -56.85 -29.55 30.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.08 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -61.38 -40.41 94.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.49 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.93 -27.82 65.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.682 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -68.52 -28.66 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.006 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.048 HG22 HD21 ' A' ' 37' ' ' LEU . 18.5 t -82.76 -25.86 8.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.078 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt -75.12 -28.18 60.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.513 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -75.65 -38.39 58.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.672 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.22 -25.77 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.401 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -70.98 -51.35 26.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.017 0.437 . . . . 0.0 110.738 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -67.64 -26.65 66.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.217 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.723 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.74 -59.06 5.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.434 -179.422 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.889 HG12 HD13 ' A' ' 30' ' ' LEU . 35.3 mt -50.31 -28.39 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.536 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -27.48 65.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.733 0.301 . . . . 0.0 110.895 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.672 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.514 HD11 ' HA ' ' A' ' 54' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.821 0.343 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HG3' HG21 ' A' ' 41' ' ' ILE . 62.6 mt-10 -67.62 -32.93 73.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -77.27 -20.1 55.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.734 0.302 . . . . 0.0 111.312 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -43.56 58.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.58 HG22 HG13 ' A' ' 57' ' ' VAL . 23.2 t -75.41 -29.3 21.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.475 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -62.75 -35.83 81.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 0.0 110.182 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 -23.86 37.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.549 0.69 . . . . 0.0 109.499 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.516 HD21 HD23 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -66.38 -25.49 66.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.875 179.439 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 25.1 tt0 -74.93 -51.54 13.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.207 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -51.3 -27.33 9.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.128 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -76.05 -40.94 52.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.832 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.53 HG22 HD13 ' A' ' 64' ' ' ILE . 19.1 t -78.08 -52.6 15.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.068 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.4 mtpp -55.55 -19.92 11.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.33 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.75 -17.57 26.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.43 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.551 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.5 pp . . . . . 0 C--N 1.331 -0.205 0 CA-C-O 120.86 0.362 . . . . 0.0 110.808 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -27.62 61.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.745 0.307 . . . . 0.0 111.063 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.422 HD13 ' CD1' ' A' ' 21' ' ' LEU . 58.8 mt -66.04 -29.73 47.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.464 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.21 -56.14 12.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.484 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -59.16 -26.87 65.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.78 0.324 . . . . 0.0 111.369 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.646 HD11 ' OE1' ' A' ' 63' ' ' GLU . 92.1 mt -79.56 -21.61 44.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.72 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -76.74 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.67 -51.55 55.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 111.742 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -66.74 -25.12 66.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.844 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.09 -57.62 11.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.989 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.06 -55.3 14.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 112.057 -178.672 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.23 -28.44 3.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.061 0.458 . . . . 0.0 111.336 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.078 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.07 -41.7 77.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.486 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -58.17 8.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.628 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 2.9 ptmt -52.1 -27.96 15.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.47 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 22.1 tttt -70.58 -25.56 63.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.502 HG21 ' HG3' ' A' ' 8' ' ' GLU . 6.9 mt -77.11 -40.79 30.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 111.089 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 1.9 pt-20 -65.89 -28.89 69.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.812 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 5.5 pt-20 -77.68 -30.92 52.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.375 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.64 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.0 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.935 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.408 ' HG2' HD21 ' A' ' 44' ' ' LEU . 11.8 tt0 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.778 0.323 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.6 t -56.11 -22.79 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.41 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.95 -29.89 55.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.897 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.03 -57.27 6.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.95 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.64 ' CG2' HD11 ' A' ' 44' ' ' LEU . 23.8 t -60.19 -29.87 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' HD11 ' A' ' 7' ' ' LEU . 7.2 tp10 -62.51 -33.27 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.645 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -27.89 53.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.794 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -67.9 -29.21 68.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.078 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.26 -25.61 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.032 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -73.44 -28.15 61.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.35 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.585 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -74.07 -24.98 59.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.054 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -56.0 8.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.937 0.399 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -61.35 -26.99 68.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.153 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.646 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.3 tm-20 -61.99 -58.93 6.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.103 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.551 HG12 HD13 ' A' ' 30' ' ' LEU . 31.5 mt -52.89 -25.2 8.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.269 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.5 mttp . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 179.93 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.699 0.285 . . . . 0.0 111.35 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HG3' HG21 ' A' ' 41' ' ' ILE . 39.2 mt-10 -74.39 -35.8 63.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.694 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.61 -19.7 60.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.704 0.288 . . . . 0.0 111.523 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -73.07 -51.04 19.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.202 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.608 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.5 t -68.4 -29.21 43.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.648 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -36.71 77.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.99 -23.92 38.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.532 0.682 . . . . 0.0 109.508 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.587 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.31 -25.14 67.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.834 179.271 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' HG3' ' HG3' ' A' ' 19' ' ' LYS . 26.0 tt0 -75.1 -44.95 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.54 -26.12 12.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.99 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -76.08 -54.45 6.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.4 t -65.0 -53.45 41.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.261 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 3.1 mtpp -53.58 -26.55 22.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.22 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.69 -10.91 38.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.46 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.626 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.66 61.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.739 0.304 . . . . 0.0 111.07 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.5 mt -73.94 -29.61 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.293 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -65.05 -56.14 14.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.599 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.46 -35.14 76.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 0.0 111.202 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.751 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.0 mt -69.97 -21.42 63.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.659 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -76.64 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.628 0.251 . . . . 0.0 111.577 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.34 -37.08 62.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.581 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.446 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.48 -24.84 45.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.746 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -57.95 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -40.5 90.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.079 -178.491 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.12 -28.21 69.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 111.081 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.935 HD11 HG22 ' A' ' 57' ' ' VAL . 0.1 OUTLIER -70.18 -55.1 10.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.673 -179.107 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.96 -58.11 6.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 111.596 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.0 -27.92 8.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.413 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HE3' HG22 ' A' ' 53' ' ' VAL . 7.0 ttpt -71.09 -28.46 64.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.999 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.495 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.9 mt -75.07 -31.35 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.636 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.92 -34.45 75.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -72.59 -29.76 63.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.461 179.559 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.635 HD13 HG23 ' A' ' 50' ' ' VAL . 5.6 mt . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.945 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.832 0.348 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.635 HG23 HD13 ' A' ' 44' ' ' LEU . 13.6 p -52.55 -30.65 14.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.33 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -60.57 -27.14 67.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.139 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -68.52 -57.25 6.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.063 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.626 ' O ' HG23 ' A' ' 57' ' ' VAL . 23.9 t -53.68 -26.08 12.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.222 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' HD11 ' A' ' 7' ' ' LEU . 6.7 mt-10 -65.2 -32.6 74.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.482 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.56 -27.94 51.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.705 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -68.62 -28.85 67.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.574 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.935 HG22 HD11 ' A' ' 37' ' ' LEU . 2.5 t -83.09 -25.52 8.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.894 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -28.18 61.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.527 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -75.27 -43.32 51.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.751 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.91 -25.15 58.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.999 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -54.1 12.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -62.87 -27.02 69.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.108 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.621 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.7 -59.0 5.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.479 HG12 HD13 ' A' ' 30' ' ' LEU . 29.9 mt -55.16 -26.15 17.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -61.72 -34.23 75.42 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.879 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.8 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.528 0.102 0 CA-C-O 120.734 0.302 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.467 ' HG2' HG21 ' A' ' 41' ' ' ILE . 29.7 mt-10 -79.01 -39.71 33.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -19.75 62.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.4 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -53.9 15.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.42 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.605 HG22 HG13 ' A' ' 57' ' ' VAL . 19.6 t -66.54 -29.3 46.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.754 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -59.48 -36.71 76.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.628 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.42 -23.83 40.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.576 0.703 . . . . 0.0 109.393 178.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.41 -25.26 67.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.912 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 42.0 tt0 -77.33 -52.89 8.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.241 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -49.99 -27.95 6.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.894 0.378 . . . . 0.0 111.197 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -76.09 -42.74 46.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.623 HG22 HD13 ' A' ' 64' ' ' ILE . 14.8 t -76.41 -48.44 27.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.2 OUTLIER -50.02 -32.38 15.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.273 -179.58 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.1 -10.82 40.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.45 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.621 -0.192 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -27.72 62.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.76 0.314 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.418 ' CD1' HD22 ' A' ' 21' ' ' LEU . 59.2 mt -67.65 -29.72 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.368 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.45 -56.18 12.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.659 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.63 -27.56 66.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.297 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.585 ' O ' HD11 ' A' ' 60' ' ' LEU . 84.5 mt -78.87 -21.58 47.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.749 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.0 -58.66 3.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.715 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.35 -43.28 61.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.758 0.313 . . . . 0.0 111.824 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.86 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.015 -179.239 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.25 -57.78 9.32 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.733 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -46.54 68.72 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.22 -28.07 38.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.075 0.464 . . . . 0.0 110.855 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.98 HD21 HG22 ' A' ' 57' ' ' VAL . 7.8 tp -70.88 -42.74 69.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.529 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.3 9.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.797 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -51.34 -27.76 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.661 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -25.97 60.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.296 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.467 HG21 ' HG2' ' A' ' 8' ' ' GLU . 10.0 mt -71.26 -57.03 8.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.8 0.333 . . . . 0.0 110.681 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -23.93 64.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.128 0.49 . . . . 0.0 110.038 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -86.33 -12.98 47.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.206 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.527 HD11 ' CG2' ' A' ' 53' ' ' VAL . 2.2 mt . . . . . 0 C--N 1.331 -0.21 0 CA-C-O 120.914 0.388 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.442 ' HG2' HD21 ' A' ' 44' ' ' LEU . 22.2 tt0 . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.761 0.315 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.462 ' HA ' HD13 ' A' ' 44' ' ' LEU . 27.1 t -55.34 -24.65 15.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -28.77 58.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.932 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -57.41 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.87 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 57' ' ' VAL . 24.7 t -62.59 -26.02 39.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -67.09 -34.66 78.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.615 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.56 -27.96 58.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.798 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.57 -28.94 65.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.009 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.98 HG22 HD21 ' A' ' 37' ' ' LEU . 21.3 t -83.13 -25.84 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.168 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -28.48 59.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.655 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.31 -42.01 46.67 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.646 HD23 HD21 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -75.48 -25.0 57.0 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.261 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.06 -55.35 9.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.984 0.421 . . . . 0.0 110.552 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.64 -27.0 68.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.242 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.21 -59.11 5.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.283 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.623 HD13 HG22 ' A' ' 18' ' ' VAL . 30.3 mt -54.42 -26.41 15.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.211 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -33.35 75.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.1 mmtt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 179.992 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.144 0 CA-C-O 120.706 0.289 . . . . 0.0 111.358 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -83.09 -35.55 25.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.355 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -73.13 -19.72 61.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -55.05 8.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.991 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.507 HG22 HG13 ' A' ' 57' ' ' VAL . 21.3 t -63.89 -29.37 47.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.277 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -36.97 75.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -23.98 41.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.461 0.648 . . . . 0.0 109.635 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.39 -25.45 67.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.721 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.426 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 36.3 tt0 -77.0 -40.57 46.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.246 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -54.29 -27.94 38.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 64' ' ' ILE . 2.9 ttpm? -76.21 -47.67 23.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.677 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.6 t -70.55 -53.31 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.445 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.0 mttt -50.05 -30.82 11.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.478 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.21 -10.99 60.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.541 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.821 HD13 ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.456 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.253 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -43.53 65.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.048 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.786 HG21 ' HG ' ' A' ' 21' ' ' LEU . 3.6 mt -59.7 -29.41 42.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.754 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -56.27 24.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -58.25 -38.59 77.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.453 . . . . 0.0 111.187 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.788 HD13 HG12 ' A' ' 64' ' ' ILE . 16.2 mt -66.15 -21.09 66.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.657 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -75.45 -55.93 5.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -53.83 -51.45 63.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.735 0.302 . . . . 0.0 111.606 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -68.15 -25.05 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.931 -179.251 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.86 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.04 -54.27 19.61 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.2 tt0 -48.53 -28.37 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.062 0.458 . . . . 0.0 111.19 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.013 HD21 HG22 ' A' ' 57' ' ' VAL . 3.2 tp -68.87 -41.14 78.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.259 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -61.7 -58.27 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.15 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -27.98 25.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 27.3 tttt -68.9 -27.43 65.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.967 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 HG11 ' A' ' 53' ' ' VAL . 8.9 mt -73.88 -31.06 29.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.903 0.382 . . . . 0.0 110.653 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -69.56 -34.6 74.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.423 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -72.53 -29.1 63.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.6 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.4 mt . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.994 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG2' HD21 ' A' ' 44' ' ' LEU . 27.1 tt0 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.695 0.283 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.22 -16.92 17.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.565 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.19 -33.21 65.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.796 0.332 . . . . 0.0 111.098 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -65.99 -57.28 8.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.539 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.5 t -59.89 -25.73 33.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.216 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.32 -37.28 85.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.72 -27.74 62.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -70.67 -29.7 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.031 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.013 HG22 HD21 ' A' ' 37' ' ' LEU . 19.8 t -83.33 -25.87 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.204 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -75.34 -28.42 59.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.667 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -41.28 57.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.16 -26.16 47.61 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -178.952 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.487 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.53 -49.38 48.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.088 0.47 . . . . 0.0 110.728 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.11 -26.82 65.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.4 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.623 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -63.41 -59.1 5.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.29 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.788 HG12 HD13 ' A' ' 30' ' ' LEU . 39.6 mt -50.58 -28.41 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.387 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -64.43 -31.49 72.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.628 179.882 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.743 0.306 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -82.24 -37.99 25.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.58 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.05 -19.87 62.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.782 0.325 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -52.84 10.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.896 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.422 HG22 HG13 ' A' ' 57' ' ' VAL . 18.1 t -61.71 -29.19 45.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.426 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -37.26 73.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.774 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 -24.34 40.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.477 0.656 . . . . 0.0 109.611 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.685 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.2 tt -65.36 -25.18 67.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.761 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 56.8 tt0 -79.09 -42.72 25.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.353 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -53.7 -27.54 28.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.105 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 tppt? -76.16 -48.36 20.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.249 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.571 HG22 HD13 ' A' ' 64' ' ' ILE . 3.2 t -70.78 -49.6 49.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.618 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 10.2 mttt -51.24 -31.73 21.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.798 0.333 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.32 -10.85 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.419 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.613 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.664 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -27.54 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.798 0.333 . . . . 0.0 111.023 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.613 HG12 HD13 ' A' ' 21' ' ' LEU . 22.3 mt -73.55 -29.61 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.467 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -56.18 18.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.684 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.91 -42.82 94.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.392 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.58 HD13 HG12 ' A' ' 64' ' ' ILE . 53.7 mt -63.63 -21.41 66.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.811 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -75.81 -59.08 2.91 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.2 tttp -50.59 -56.32 12.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.768 0.318 . . . . 0.0 111.753 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.74 -24.99 67.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.767 -179.422 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.04 -57.88 10.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.896 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.518 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.14 -56.44 9.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.072 -178.498 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.518 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -47.94 -28.36 2.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.388 . . . . 0.0 111.412 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.059 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -67.54 -39.88 85.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.344 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -58.2 5.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.469 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -52.89 -27.68 19.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.341 -179.743 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.409 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 10.6 tttt -68.5 -28.73 67.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 mt -73.63 -31.0 30.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.657 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.19 -33.93 74.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.466 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -73.24 -29.2 62.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.62 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.7 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.901 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.487 ' HB3' HD21 ' A' ' 44' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.706 0.289 . . . . 0.0 111.118 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -53.37 -24.69 9.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.439 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -72.43 -36.5 68.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.89 0.376 . . . . 0.0 110.973 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -62.96 -57.23 11.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.3 t -57.93 -28.05 32.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.372 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.46 -36.24 83.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 110.728 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.34 -27.73 60.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.969 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.27 -29.26 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.377 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.059 HG22 HD21 ' A' ' 37' ' ' LEU . 17.5 t -83.27 -26.67 7.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.347 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.47 -28.38 59.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.691 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -76.79 -40.77 47.02 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.51 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.08 -25.81 47.84 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.978 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 -52.41 17.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.878 0.371 . . . . 0.0 110.55 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.46 -26.97 68.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.085 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.48 -59.13 5.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.58 HG12 HD13 ' A' ' 30' ' ' LEU . 35.2 mt -55.01 -25.69 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.254 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.02 -31.85 61.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.369 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.236 -179.635 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.421 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.736 0.303 . . . . 0.0 111.065 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' CG2' ' A' ' 41' ' ' ILE . 53.7 mt-10 -75.5 -37.0 60.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -19.95 60.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.432 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.22 -48.81 40.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.006 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.444 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.6 t -68.64 -29.3 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.514 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.0 -36.52 77.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.458 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -23.86 40.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.639 0.733 . . . . 0.0 109.407 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.749 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.4 OUTLIER -65.71 -25.22 67.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.982 179.38 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -75.87 -55.33 5.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.398 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -47.14 -30.91 3.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -37.94 57.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.769 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.749 HG23 ' O ' ' A' ' 14' ' ' LEU . 21.4 t -78.15 -48.66 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.303 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -31.55 17.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.335 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.16 -10.98 39.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.542 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.455 HD22 ' CD1' ' A' ' 27' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.841 0.353 . . . . 0.0 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -27.81 69.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.455 ' CD1' HD22 ' A' ' 21' ' ' LEU . 25.6 mt -65.42 -29.76 48.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.501 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -64.66 -56.25 15.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.661 -179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.06 -26.89 66.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.727 0.298 . . . . 0.0 111.226 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 87.9 mt -77.21 -21.77 53.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.517 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -59.44 2.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.688 0.28 . . . . 0.0 111.724 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.03 -37.82 61.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.786 0.327 . . . . 0.0 111.722 -179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.77 -24.87 41.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.831 -179.409 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.7 -57.96 8.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.794 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.04 74.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.552 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -27.98 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.189 0.519 . . . . 0.0 110.561 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.115 HD21 HG22 ' A' ' 57' ' ' VAL . 12.5 tp -76.55 -38.9 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.536 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -28.48 69.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.107 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -79.05 -27.63 43.13 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -73.13 -34.18 65.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.49 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.41 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 12.3 mt -67.37 -57.7 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.721 0.296 . . . . 0.0 110.701 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -58.28 -23.97 57.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.195 0.521 . . . . 0.0 110.044 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -84.81 -12.88 52.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.162 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.2 mt . . . . . 0 C--O 1.231 0.128 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.748 0.309 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.69 -22.19 14.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.417 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -72.99 -29.73 63.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.1 -57.29 6.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.867 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.1 t -57.91 -28.1 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 -37.78 88.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.81 -27.99 63.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.728 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.57 -30.28 69.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.115 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.03 -25.55 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.164 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.7 -27.92 61.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.458 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.407 ' CE ' ' HG3' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -75.24 -40.94 58.52 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.581 HD23 HD21 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -76.89 -25.09 52.63 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.032 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -53.74 14.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.639 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -64.75 -26.89 68.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.524 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.26 -59.09 5.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.699 HD13 HG22 ' A' ' 18' ' ' VAL . 28.1 mt -56.42 -25.41 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.231 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.36 75.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.922 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 39.9 mtpt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.738 179.951 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.497 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.739 0.304 . . . . 0.0 111.334 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.416 ' HG2' HG21 ' A' ' 41' ' ' ILE . 30.7 mt-10 -80.27 -37.69 32.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.504 -179.439 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -19.74 61.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.348 -179.799 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -48.96 25.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.447 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.635 HG22 HG13 ' A' ' 57' ' ' VAL . 17.8 t -68.21 -29.2 43.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.709 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -36.49 77.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.606 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.05 -24.0 38.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.445 0.64 . . . . 0.0 109.768 178.773 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.704 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.5 tt -66.37 -25.08 66.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.753 179.497 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.417 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 27.6 tt0 -77.27 -46.46 23.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -179.626 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -49.6 -27.86 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -76.21 -48.69 19.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.388 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.7 t -70.0 -51.46 39.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.7 mttt -51.0 -31.17 17.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.798 0.333 . . . . 0.0 111.129 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.62 -10.91 47.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.472 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.842 HD22 HD13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.362 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 -179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -27.74 63.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.725 0.298 . . . . 0.0 110.955 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.842 HD13 HD22 ' A' ' 21' ' ' LEU . 29.4 mt -67.63 -29.79 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.711 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -43.65 71.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.93 -179.179 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -70.14 -26.85 64.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.685 0.279 . . . . 0.0 111.432 -179.419 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 72.8 mt -81.06 -21.62 39.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.494 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.74 -59.15 2.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.343 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -52.64 -48.23 66.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.64 -179.539 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.22 -25.2 65.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.736 -179.484 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.25 -57.87 9.83 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.001 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.87 -55.06 18.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.904 -178.596 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.7 tt0 -49.33 -28.47 4.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 5.0 tp -67.96 -38.56 82.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.281 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -66.48 -58.36 5.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.259 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.439 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 3.1 pttt -51.61 -27.51 11.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.202 -179.871 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.484 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 2.7 tptm -70.8 -25.81 63.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.0 mt -75.71 -42.1 40.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.08 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.26 -30.72 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.608 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 2.9 pt-20 -75.62 -30.66 59.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.095 0.474 . . . . 0.0 110.513 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.3 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.791 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.606 ' HB3' HD21 ' A' ' 44' ' ' LEU . 11.7 tt0 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.604 0.24 . . . . 0.0 111.334 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.3 t -52.5 -25.11 7.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.302 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.55 -28.6 65.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -73.29 -57.18 4.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.4 t -55.51 -26.3 19.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.479 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -65.41 -38.05 88.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.99 0.424 . . . . 0.0 110.591 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -72.32 -27.61 62.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.893 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -71.41 -28.9 64.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.493 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.32 -27.7 7.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.283 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -75.61 -28.42 58.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.653 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -76.29 -40.18 52.33 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -178.81 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.07 -26.16 48.05 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -71.05 -49.47 44.4 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.934 0.397 . . . . 0.0 110.637 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.72 -26.9 65.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.238 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.506 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -62.36 -59.26 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.095 -179.631 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.58 HG12 HD13 ' A' ' 30' ' ' LEU . 39.1 mt -51.31 -25.86 4.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -33.99 75.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.818 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.401 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.782 0.325 . . . . 0.0 111.195 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.511 ' HG3' HG21 ' A' ' 41' ' ' ILE . 45.9 mt-10 -76.76 -31.38 57.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.601 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -77.05 -22.34 53.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.731 0.3 . . . . 0.0 111.307 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.28 -55.04 8.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.01 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.587 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -65.4 -29.38 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.508 -179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.45 -37.18 74.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.718 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.05 -24.26 40.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.613 0.72 . . . . 0.0 109.468 178.687 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -64.52 -25.2 67.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.815 179.237 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.418 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 47.6 tt0 -77.56 -43.89 30.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.277 -179.417 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -52.94 -29.69 30.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.188 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -76.03 -50.57 14.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.346 -179.786 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.582 HG13 HG23 ' A' ' 27' ' ' ILE . 28.3 t -66.19 -53.1 40.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.509 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.418 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.5 mttt -50.52 -30.51 13.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.353 -179.497 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.06 -11.06 36.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.435 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.778 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.106 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.932 0.396 . . . . 0.0 110.906 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.778 HG12 HD13 ' A' ' 21' ' ' LEU . 2.8 mp -55.88 -29.46 26.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.769 -179.589 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.23 -56.27 24.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.201 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.02 -32.57 69.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 111.091 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.956 HD23 ' HG ' ' A' ' 60' ' ' LEU . 4.5 mt -70.7 -21.13 62.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.555 -179.667 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -78.1 -57.61 3.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.048 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -58.42 6.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.85 0.357 . . . . 0.0 111.789 -179.138 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -62.2 -25.02 67.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -179.338 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.15 -57.53 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.912 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.77 -54.12 26.01 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.596 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.495 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.5 tm-20 -47.94 -28.38 2.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.033 0.444 . . . . 0.0 111.204 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.012 HD21 HG22 ' A' ' 57' ' ' VAL . 9.2 tp -70.96 -40.58 71.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.3 -179.563 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -61.88 -58.33 8.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.604 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -51.42 -28.04 11.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.386 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.0 -28.66 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.88 -179.955 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.511 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.8 mt -75.18 -31.61 24.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.673 179.654 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -69.77 -31.45 69.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.392 179.642 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -75.61 -29.47 59.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.483 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.6 mt . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.954 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.821 0.343 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.9 p -50.7 -29.55 7.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.53 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -72.06 -29.91 64.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.158 -179.863 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -67.4 -57.25 6.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 -179.821 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.509 ' O ' HG23 ' A' ' 57' ' ' VAL . 43.6 t -59.61 -25.92 33.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.53 -37.08 85.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.95 0.405 . . . . 0.0 110.472 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.04 -27.87 62.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.719 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.98 -29.01 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.031 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.012 HG22 HD21 ' A' ' 37' ' ' LEU . 22.3 t -83.23 -25.69 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.177 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -75.2 -28.34 59.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.506 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -39.44 59.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.646 -179.088 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.956 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -77.25 -24.88 51.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.54 0.21 . . . . 0.0 111.52 -179.566 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -55.01 13.07 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.008 0.432 . . . . 0.0 110.283 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.94 -26.92 68.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.976 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.8 mt-10 -60.45 -51.33 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.026 -179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.861 ' CG1' HD22 ' A' ' 30' ' ' LEU . 24.4 mt -59.39 -25.68 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -34.68 75.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.833 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.756 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.551 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.733 0.301 . . . . 0.0 111.173 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.565 ' HG2' HG21 ' A' ' 41' ' ' ILE . 33.2 mt-10 -83.16 -39.71 20.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.605 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -19.71 64.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.147 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.67 -55.13 9.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.63 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.0 t -62.56 -29.34 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.52 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -36.98 75.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.654 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.75 -23.87 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.566 0.698 . . . . 0.0 109.721 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.699 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -66.61 -25.09 66.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.919 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 30.3 tt0 -79.12 -52.71 7.82 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.438 -179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -47.36 -30.23 3.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.837 0.351 . . . . 0.0 111.329 -179.647 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.571 ' HD3' HG21 ' A' ' 64' ' ' ILE . 15.5 tttm -76.19 -36.86 58.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.011 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.644 HG22 HD13 ' A' ' 64' ' ' ILE . 24.9 t -78.21 -54.22 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.35 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -50.53 -29.83 11.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.44 -179.493 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.35 -12.83 36.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.444 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.945 -179.907 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -27.7 59.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.888 0.375 . . . . 0.0 111.099 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.2 mt -68.29 -29.6 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -179.673 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.05 -56.12 17.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.702 -179.42 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -57.86 -35.95 71.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 0.0 111.223 -179.579 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 64.9 mt -70.72 -21.32 62.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.691 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -75.28 -59.14 2.88 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -51.97 41.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.196 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.459 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 5.1 ttpt -67.55 -24.93 65.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.413 . . . . 0.0 112.084 -179.198 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.91 -57.74 11.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.951 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.66 -54.09 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.055 -178.704 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.487 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 5.9 tt0 -48.25 -28.57 3.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.075 0.464 . . . . 0.0 111.103 -179.826 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.992 HD21 HG22 ' A' ' 57' ' ' VAL . 8.4 tp -69.47 -40.29 77.2 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.186 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -58.13 9.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.358 -179.769 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -54.65 -29.44 52.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.293 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.45 -26.82 68.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.0 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 44' ' ' LEU . 8.2 mt -75.39 -30.2 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 110.819 179.776 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.11 -45.8 83.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.616 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -62.14 -38.87 90.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.378 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.936 HD11 HG21 ' A' ' 53' ' ' VAL . 11.0 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.072 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.702 0.287 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 16.1 t -54.91 -23.89 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.341 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -72.36 -34.96 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.012 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -66.6 -57.32 7.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.936 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -57.55 -25.95 25.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.342 179.928 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.551 ' HG2' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -66.0 -37.74 86.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.921 0.391 . . . . 0.0 110.62 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.37 -27.89 62.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.859 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -71.07 -28.89 64.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.992 HG22 HD21 ' A' ' 37' ' ' LEU . 21.5 t -83.32 -25.98 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -75.46 -28.61 59.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.795 -179.49 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -39.96 63.05 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -178.91 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.38 -26.21 46.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.228 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -40.35 70.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.969 0.414 . . . . 0.0 110.892 -179.789 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -76.48 -26.83 55.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.227 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.578 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.51 -59.28 4.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.153 -179.739 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.644 HD13 HG22 ' A' ' 18' ' ' VAL . 38.7 mt -51.97 -27.95 9.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -62.17 -33.15 73.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.858 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.852 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.832 0.348 . . . . 0.0 111.149 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -71.32 -33.89 70.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.21 -19.53 56.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.509 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.58 -39.07 32.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.814 -179.232 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.424 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.1 t -79.16 -29.55 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -65.51 -34.68 78.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.054 0.454 . . . . 0.0 110.087 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.63 -25.07 35.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.606 178.463 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.649 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.7 tt -66.55 -25.6 66.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.863 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -76.77 -46.33 25.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.018 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -51.75 -27.05 10.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.02 -43.85 42.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.069 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.573 HG22 HD13 ' A' ' 64' ' ' ILE . 2.3 t -76.78 -57.45 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.258 -179.807 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -53.06 -23.83 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.236 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -18.14 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.125 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.58 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.2 pp . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.941 179.875 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.582 -0.207 . . . . 0.0 112.582 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -27.65 54.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.322 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' CD1' ' A' ' 21' ' ' LEU . 53.7 mt -65.08 -29.64 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.479 -179.63 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -64.15 -56.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.697 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.13 -28.02 67.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.693 0.282 . . . . 0.0 111.328 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.709 ' O ' HD11 ' A' ' 60' ' ' LEU . 88.5 mt -76.5 -21.62 55.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.639 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -78.22 -59.52 2.74 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.42 -36.96 46.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.829 -179.258 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.704 ' HE2' HD12 ' A' ' 60' ' ' LEU . 2.6 ttpt -82.19 -24.81 34.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.141 -179.152 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.12 -57.88 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.479 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -42.46 79.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.564 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.85 -28.2 67.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.096 0.474 . . . . 0.0 110.918 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.087 HD21 HG22 ' A' ' 57' ' ' VAL . 7.0 tp -69.04 -44.74 72.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.554 -179.29 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -59.88 -58.25 9.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.777 0.322 . . . . 0.0 111.544 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -54.31 -27.81 38.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.22 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 1.7 tptp -67.63 -25.98 66.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.057 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 44' ' ' LEU . 7.2 mt -77.1 -34.01 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.86 0.362 . . . . 0.0 110.48 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.6 -30.81 71.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.385 179.391 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.8 pt-20 -78.01 -29.45 49.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.477 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.859 HD11 HG21 ' A' ' 53' ' ' VAL . 14.6 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 CA--C 1.528 0.122 0 CA-C-O 120.673 0.273 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.29 -19.7 24.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.445 179.928 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -76.94 -26.48 54.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.331 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -57.14 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 0.0 110.591 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.859 HG21 HD11 ' A' ' 44' ' ' LEU . 21.3 t -54.04 -31.98 22.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -59.17 -38.99 81.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.983 0.42 . . . . 0.0 110.616 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -71.88 -27.69 63.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.743 179.631 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -67.1 -28.62 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.087 HG22 HD21 ' A' ' 37' ' ' LEU . 11.0 t -82.38 -25.6 8.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.037 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.19 60.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.466 -179.619 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.19 -40.48 52.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -178.919 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.709 HD11 ' O ' ' A' ' 30' ' ' LEU . 1.1 tt -77.0 -24.83 52.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.23 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.69 -54.63 11.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.02 0.438 . . . . 0.0 110.483 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -63.61 -26.96 68.92 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.961 179.779 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.595 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.9 tm-20 -61.27 -58.71 7.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.048 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.573 HD13 HG22 ' A' ' 18' ' ' VAL . 32.1 mt -54.08 -27.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.197 179.843 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -32.9 74.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.701 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.482 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.1 tt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.782 0.325 . . . . 0.0 111.047 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.02 -33.7 68.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.263 -179.759 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.25 -19.94 55.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.473 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -45.52 65.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.46 -179.348 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.669 HG22 HG13 ' A' ' 57' ' ' VAL . 22.0 t -78.38 -29.18 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 -179.394 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -35.6 81.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.141 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -26.59 35.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.476 0.655 . . . . 0.0 109.62 178.711 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.626 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -64.38 -25.39 68.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.913 179.557 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.86 -45.51 24.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.0 -26.82 11.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -48.6 19.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.648 HG22 HD13 ' A' ' 64' ' ' ILE . 3.3 t -70.9 -56.04 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.58 -20.49 8.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.05 -16.01 27.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.633 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.762 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.764 0.316 . . . . 0.0 111.002 -179.86 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -27.84 26.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.762 HG21 HD11 ' A' ' 21' ' ' LEU . 16.7 mt -68.79 -29.64 44.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.442 -179.485 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.91 -56.07 17.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.527 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -55.95 -26.9 50.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 -179.722 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.691 HD22 ' HG ' ' A' ' 60' ' ' LEU . 56.1 mt -81.09 -21.14 40.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.785 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -74.43 -54.42 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.722 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -54.55 -52.11 63.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.752 0.311 . . . . 0.0 111.761 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.9 ttpp -66.69 -25.08 66.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.924 -179.408 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.75 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.067 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.99 -56.16 11.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.127 -178.593 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.516 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 20.3 tt0 -47.85 -28.5 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 111.348 -179.688 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.04 HD21 HG22 ' A' ' 57' ' ' VAL . 6.2 tp -68.99 -38.68 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.472 -179.459 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -66.38 -58.26 5.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.399 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -52.19 -28.02 16.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.449 -179.629 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -69.34 -25.91 64.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mt -77.8 -34.91 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 110.734 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.93 -29.67 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 179.719 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -78.5 -30.89 47.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 110.575 179.734 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.5 mt . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.869 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.718 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.2 tt0 . . . . . 0 N--CA 1.457 -0.09 0 CA-C-O 120.781 0.324 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.05 -30.17 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.281 -179.904 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -67.64 -38.57 84.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -60.18 -57.19 13.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.993 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.705 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -56.78 -25.87 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.975 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.471 ' HG2' HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.72 -38.53 89.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.883 0.373 . . . . 0.0 110.592 179.853 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.36 -27.86 63.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.804 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.62 -28.9 65.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.06 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.04 HG22 HD21 ' A' ' 37' ' ' LEU . 23.0 t -83.12 -25.82 7.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.42 -28.49 59.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.668 -179.538 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.84 -40.52 63.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.875 -178.992 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.691 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.18 -25.83 47.36 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.238 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -71.79 -40.05 69.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.945 0.403 . . . . 0.0 110.794 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.38 -26.88 56.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.272 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.613 ' OE1' HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -63.87 -59.11 4.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -179.68 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.648 HD13 HG22 ' A' ' 18' ' ' VAL . 35.3 mt -51.87 -26.48 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.236 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -31.65 69.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.766 179.895 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.803 0.335 . . . . 0.0 111.153 . . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.47 -31.84 58.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.536 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.29 -23.92 51.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.552 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -55.2 14.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 111.338 -179.393 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.698 HG22 HG13 ' A' ' 57' ' ' VAL . 21.7 t -70.03 -28.96 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.519 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.0 -36.14 78.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.463 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.33 -24.42 39.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.513 0.673 . . . . 0.0 109.445 178.67 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.563 HD21 HD23 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -66.15 -25.22 66.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.938 179.361 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.444 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.4 tt0 -70.7 -47.04 61.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.24 -179.373 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -50.05 -26.58 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.216 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -76.1 -43.74 41.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.536 -179.775 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.441 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 2.7 t -78.13 -43.48 27.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.409 -179.498 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.7 mtpt -49.79 -36.52 26.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.028 0.442 . . . . 0.0 110.737 179.777 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.47 -10.95 35.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.795 179.294 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 18' ' ' VAL . 4.8 tp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.105 -179.56 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -27.89 64.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.845 0.355 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mt -73.37 -29.83 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.13 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -65.68 -56.18 13.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.586 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.03 -36.03 74.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.865 0.364 . . . . 0.0 111.281 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.712 HD22 ' HG ' ' A' ' 60' ' ' LEU . 96.6 mt -70.7 -21.62 62.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.833 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.47 -57.25 4.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -54.83 -42.33 71.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.217 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -73.26 -25.45 60.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.638 -179.502 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.12 -57.81 10.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.938 0.399 . . . . 0.0 111.913 -179.167 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.37 -53.22 38.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.929 -178.801 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.49 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.2 tt0 -49.21 -28.55 4.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 111.176 -179.815 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.979 HD21 HG22 ' A' ' 57' ' ' VAL . 4.2 tp -71.44 -38.79 71.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.501 -179.522 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -58.34 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.73 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.43 -28.13 12.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.476 -179.512 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.415 ' CD ' HG22 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -69.44 -28.66 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.974 -179.876 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 HD22 ' A' ' 7' ' ' LEU . 7.2 mt -75.77 -31.92 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.896 0.379 . . . . 0.0 110.506 179.707 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -68.1 -31.88 71.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.385 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -75.8 -29.75 58.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.421 179.496 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.896 HD11 HG21 ' A' ' 53' ' ' VAL . 14.1 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.527 0.066 0 CA-C-O 120.706 0.288 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -54.2 -24.1 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -66.74 -36.75 83.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -70.65 -57.11 5.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.878 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 44' ' ' LEU . 20.6 t -50.24 -26.34 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.465 -179.931 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.2 -32.67 74.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -27.95 47.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.725 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -68.66 -28.87 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.979 HG22 HD21 ' A' ' 37' ' ' LEU . 30.9 t -83.14 -25.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.811 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -74.04 -28.1 61.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.51 -179.609 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -39.41 63.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.041 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.0 -25.75 48.18 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.165 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -46.59 64.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.949 0.404 . . . . 0.0 110.88 -179.86 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -71.79 -26.98 62.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.416 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 30' ' ' LEU . 1.3 mm-40 -62.71 -59.18 5.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.031 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.45 HG12 HD13 ' A' ' 30' ' ' LEU . 38.1 mt -51.22 -28.13 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.289 179.957 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -29.76 68.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 -179.966 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.5 mttm . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.097 -179.905 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.638 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.805 0.336 . . . . 0.0 111.062 . . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -74.3 -33.23 63.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.137 -179.8 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.19 -20.11 55.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.357 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.77 -43.13 38.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.333 -179.559 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.658 HG12 ' HE2' ' A' ' 38' ' ' LYS . 21.9 t -74.62 -29.06 22.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.706 -179.568 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -36.43 81.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.018 0.437 . . . . 0.0 110.352 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -23.85 37.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.548 0.689 . . . . 0.0 109.514 178.518 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.615 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -66.64 -25.06 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.054 179.527 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -76.33 -50.63 13.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.309 -179.463 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -51.7 -26.18 8.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.783 0.325 . . . . 0.0 111.074 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -41.55 49.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 14' ' ' LEU . 11.7 t -78.14 -51.81 17.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.19 -179.979 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.5 -31.6 10.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.464 -179.649 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.96 -10.84 37.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.52 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.67 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.823 0.344 . . . . 0.0 110.987 -179.932 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -37.53 77.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.897 0.38 . . . . 0.0 110.932 179.833 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.67 HG12 HD13 ' A' ' 21' ' ' LEU . 4.0 mt -71.19 -29.5 36.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.526 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -62.25 -56.21 20.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.7 -179.363 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.1 -51.29 70.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.959 0.409 . . . . 0.0 111.466 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.743 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.1 mt -58.4 -21.09 49.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.122 -179.128 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -74.09 -59.04 2.91 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -178.965 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -45.41 62.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.927 -179.234 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.417 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.23 -24.93 61.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.024 -179.167 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.16 -57.86 9.13 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.694 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.21 81.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.936 -178.644 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -56.79 -28.03 60.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.105 0.479 . . . . 0.0 110.889 179.997 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.062 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -71.34 -41.7 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.287 -179.505 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.658 ' HE2' HG12 ' A' ' 11' ' ' VAL . 20.6 mttm -58.64 -58.3 9.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.675 -179.575 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 13.8 pttt -51.64 -27.77 12.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.685 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 22.8 tttp -73.61 -25.8 60.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.459 -179.562 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.27 -39.11 34.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 111.239 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -63.92 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 179.666 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.46 -30.94 60.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.485 179.609 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.814 HD11 HG21 ' A' ' 53' ' ' VAL . 11.7 mt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.988 179.976 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.799 0.333 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -51.9 -30.27 12.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.373 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -29.12 65.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.082 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -68.87 -57.24 5.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.984 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.814 HG21 HD11 ' A' ' 44' ' ' LEU . 12.0 t -57.12 -26.91 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.34 -36.1 83.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -73.89 -27.92 61.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.768 179.757 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.44 -29.0 66.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.062 HG22 HD21 ' A' ' 37' ' ' LEU . 16.5 t -83.24 -25.71 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.066 179.935 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -75.11 -28.26 60.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -39.93 61.76 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.132 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.743 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -78.17 -25.73 47.36 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -178.996 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -49.45 47.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.002 0.429 . . . . 0.0 110.644 -179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.06 -26.68 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.099 179.855 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.588 ' CB ' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -62.0 -56.33 20.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 -179.632 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.664 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -57.03 -25.87 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.264 179.969 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -62.58 -31.24 72.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.878 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.6 mttp . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.926 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.122 0 CA-C-O 120.685 0.279 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HG2' HG21 ' A' ' 41' ' ' ILE . 80.0 mt-10 -79.63 -39.91 30.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.276 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -19.78 63.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.106 -179.946 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -46.75 67.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.069 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.483 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -71.89 -29.06 32.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.604 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 -36.64 80.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.563 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.33 -24.53 37.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.589 0.709 . . . . 0.0 109.712 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -65.9 -25.07 66.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.965 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.458 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -75.67 -41.05 54.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.388 -179.273 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -54.98 -28.12 49.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.307 -179.856 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -48.42 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.487 -179.688 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.521 HG22 HD13 ' A' ' 64' ' ' ILE . 3.7 t -69.71 -47.77 68.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.491 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 4.3 mtpm? -51.43 -28.76 13.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.232 -179.71 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.11 -10.95 37.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.416 -0.274 . . . . 0.0 112.416 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -62.11 1.95 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 110.942 179.872 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.475 HG23 HG13 ' A' ' 18' ' ' VAL . 7.2 mt -60.48 -29.76 45.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.524 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -56.14 26.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.772 0.32 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.83 -30.83 67.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.974 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.952 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.4 mt -70.57 -21.8 62.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.385 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -78.6 -59.32 2.83 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.944 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -53.05 -36.72 60.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.776 0.322 . . . . 0.0 111.828 -179.041 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.743 ' HE3' HD12 ' A' ' 60' ' ' LEU . 7.4 ttpp -82.04 -24.99 35.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.991 -179.321 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.68 -57.81 8.86 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.532 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -42.29 84.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.528 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.89 -28.16 65.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.013 0.435 . . . . 0.0 110.995 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.002 HD21 HG22 ' A' ' 57' ' ' VAL . 2.9 tp -70.41 -47.0 62.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.52 -179.244 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -58.17 9.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 111.411 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -27.92 13.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.441 -179.714 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 5.3 tttp -69.87 -29.6 66.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.036 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.5 mt -75.11 -31.79 25.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.756 179.774 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -31.44 69.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.494 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.89 -29.9 58.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.574 179.667 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.52 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.4 mt . . . . . 0 C--N 1.326 -0.432 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.894 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.419 ' HG2' HD21 ' A' ' 44' ' ' LEU . 3.8 tt0 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.4 t -55.63 -23.2 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.415 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.2 tttt -72.9 -32.47 65.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.943 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -65.93 -57.17 8.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.837 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.7 t -57.8 -28.05 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 179.883 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.67 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.945 0.402 . . . . 0.0 110.617 179.812 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -68.67 -27.86 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.784 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -70.26 -28.76 65.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.028 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.002 HG22 HD21 ' A' ' 37' ' ' LEU . 12.2 t -82.11 -25.81 9.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -75.18 -28.64 60.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.259 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -37.48 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.613 -179.229 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.952 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.2 tt -76.59 -27.69 55.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.405 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -56.18 11.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.051 0.453 . . . . 0.0 110.49 179.868 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -62.65 -26.87 68.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.821 179.626 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.826 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.91 -44.54 97.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.956 -179.92 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 13.9 mt -67.35 -24.26 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 110.885 179.505 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -33.87 76.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.769 179.925 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.732 0.301 . . . . 0.0 111.239 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.445 ' HG3' HG21 ' A' ' 41' ' ' ILE . 84.1 mt-10 -77.2 -33.62 56.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.405 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.22 -24.58 59.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.104 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -70.42 -52.0 25.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.503 HG22 ' CG1' ' A' ' 57' ' ' VAL . 26.1 t -63.65 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 -179.976 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -38.21 70.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.55 -28.85 46.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.544 0.688 . . . . 0.0 109.485 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.712 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.8 tt -59.75 -25.22 64.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.812 179.121 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.438 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.6 tt0 -77.73 -43.52 30.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.305 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -52.28 -30.98 30.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.179 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -76.06 -37.23 58.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.294 -179.835 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.539 HG22 HD13 ' A' ' 64' ' ' ILE . 20.2 t -78.1 -53.46 14.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.626 -179.594 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.438 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -49.77 -30.11 8.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.499 -179.468 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.8 -12.88 37.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.436 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.41 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.014 -179.984 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -27.58 64.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 111.062 -179.981 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.41 HG12 HD13 ' A' ' 21' ' ' LEU . 37.5 mt -70.74 -29.56 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.499 -179.597 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.07 -56.27 16.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.815 -179.156 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.73 -38.66 82.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.4 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.71 ' O ' HD11 ' A' ' 60' ' ' LEU . 80.0 mt -67.78 -21.37 65.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.841 -179.369 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.08 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.59 -43.16 65.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 0.0 111.778 -179.279 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 60' ' ' LEU . 7.1 ttpt -74.73 -24.95 58.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.908 -179.288 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -57.98 8.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.746 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.81 -51.33 34.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.814 -178.709 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.462 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.7 tt0 -50.86 -28.24 9.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.884 179.904 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.042 HD21 HG22 ' A' ' 57' ' ' VAL . 9.6 tp -70.26 -41.81 72.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.424 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.07 -58.23 9.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.647 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -52.97 -27.77 20.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.347 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 3.7 tppp? -70.46 -25.67 63.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.445 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.5 mt -76.71 -36.95 27.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 0.0 111.083 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -67.95 -29.63 68.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.764 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -77.66 -29.95 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.15 0.5 . . . . 0.0 110.551 179.552 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.545 HD21 ' HG2' ' A' ' 49' ' ' GLU . 4.2 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.152 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.8 tt0 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.1 -20.26 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.469 -179.958 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -32.16 64.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.215 -179.826 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.2 ttpp -67.95 -57.3 6.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.557 ' O ' HG23 ' A' ' 57' ' ' VAL . 51.4 t -58.99 -25.98 31.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.044 179.959 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -37.99 88.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.504 179.798 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -71.31 -28.77 64.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.684 179.722 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.66 -28.89 66.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.912 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.042 HG22 HD21 ' A' ' 37' ' ' LEU . 18.7 t -83.06 -25.69 8.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.013 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -28.36 60.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.568 -179.606 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -38.73 58.11 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.078 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.826 HD12 ' HE2' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -77.58 -25.55 50.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.256 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.13 -54.99 10.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.01 0.433 . . . . 0.0 110.509 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.8 -26.92 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.526 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.45 -59.11 5.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.17 -179.666 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.539 HD13 HG22 ' A' ' 18' ' ' VAL . 36.6 mt -52.73 -27.45 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.387 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -64.75 -29.87 70.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.916 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.1 mttm . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.017 -179.925 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.652 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.718 0.294 . . . . 0.0 111.307 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.42 ' HG3' HG21 ' A' ' 41' ' ' ILE . 32.1 mt-10 -78.67 -38.34 39.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.458 -179.452 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -19.86 62.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.534 -179.633 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -73.06 -53.7 10.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 -179.734 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 57' ' ' VAL . 21.8 t -63.89 -29.31 46.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.72 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -58.57 -37.06 74.95 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.727 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.22 -23.91 40.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.582 0.706 . . . . 0.0 109.463 178.73 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.616 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.23 -25.22 67.59 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.946 179.36 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -74.24 -42.1 60.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.117 -179.38 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -56.81 -26.02 57.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.176 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -51.88 11.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.432 -179.768 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.459 HG22 HD13 ' A' ' 64' ' ' ILE . 8.5 t -68.12 -47.79 76.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.446 -179.697 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.5 mtpt -50.81 -27.16 6.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.327 -179.704 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.13 -10.86 37.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.533 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.641 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.667 -179.832 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.461 -0.256 . . . . 0.0 112.461 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -27.64 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.814 0.34 . . . . 0.0 111.023 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.641 HG12 HD13 ' A' ' 21' ' ' LEU . 23.8 mt -68.55 -29.67 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.459 -179.537 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.96 -56.15 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.64 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.18 -30.43 70.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 111.281 -179.497 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.729 ' O ' HD11 ' A' ' 60' ' ' LEU . 95.0 mt -73.6 -21.35 60.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.491 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -78.06 -59.4 2.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.728 -179.345 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -33.59 59.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.793 0.33 . . . . 0.0 111.566 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -81.96 -24.89 35.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.813 -179.521 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -65.71 -58.05 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.766 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.9 -41.94 74.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.878 -178.832 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.5 -28.27 66.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.037 0.446 . . . . 0.0 110.789 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.098 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -70.26 -40.75 74.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.461 -179.41 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -61.72 -58.32 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.599 -179.462 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -50.59 -28.27 8.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.559 -179.601 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -69.79 -28.42 65.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.87 -179.995 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.42 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.3 mt -76.2 -30.26 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.586 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.89 -33.34 73.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.244 179.468 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.494 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -74.5 -30.61 61.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.342 179.61 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.909 HD11 HG21 ' A' ' 53' ' ' VAL . 13.3 mt . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.843 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.431 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.4 tp10 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.634 0.254 . . . . 0.0 111.246 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.32 -18.85 12.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.625 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -74.65 -29.88 61.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.201 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -78.0 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.089 -179.782 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.909 HG21 HD11 ' A' ' 44' ' ' LEU . 17.1 t -57.23 -25.86 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.29 -179.993 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.8 -35.17 79.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.392 . . . . 0.0 110.55 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -75.18 -27.67 59.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.739 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -69.29 -30.77 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.115 -179.827 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.098 HG22 HD21 ' A' ' 37' ' ' LEU . 9.6 t -83.3 -25.57 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.183 -179.958 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.98 -27.97 60.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.579 -179.524 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -76.06 -39.54 55.23 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -178.943 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.729 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -77.97 -25.26 48.03 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.273 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -52.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.05 0.452 . . . . 0.0 110.715 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -66.5 -26.92 67.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.225 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.678 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.4 tm-20 -61.89 -56.12 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.459 HD13 HG22 ' A' ' 18' ' ' VAL . 30.0 mt -56.15 -26.8 22.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.045 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -34.22 75.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.81 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.7 mmtt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.606 179.854 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.3 tt . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.792 0.33 . . . . 0.0 111.03 . . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -73.87 -32.99 63.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.17 -20.21 55.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.341 -179.84 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -51.13 48.05 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.894 0.378 . . . . 0.0 111.101 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.498 HG22 HG13 ' A' ' 57' ' ' VAL . 24.4 t -72.7 -29.19 29.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.44 -179.783 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -61.44 -36.57 80.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.406 179.985 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.26 -24.01 37.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.499 0.666 . . . . 0.0 109.56 178.623 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.503 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -66.01 -25.21 66.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.883 179.403 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.405 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.2 tt0 -75.36 -47.78 26.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.221 -179.585 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -50.25 -28.23 7.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.157 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -76.11 -41.71 49.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.342 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 14' ' ' LEU . 2.5 t -75.46 -55.08 12.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.422 -179.705 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 6.0 mtpt -50.82 -29.33 11.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.357 -179.661 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.08 -11.68 35.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.4 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.928 -179.965 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -27.82 47.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 0.0 111.102 -179.913 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 71.4 mt -76.25 -29.58 19.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.291 -179.604 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -68.39 -45.76 71.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.184 -179.752 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -69.19 -29.35 67.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.389 . . . . 0.0 110.818 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.879 HD21 ' HB3' ' A' ' 63' ' ' GLU . 24.1 mt -74.53 -21.89 59.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.293 -179.841 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.65 -59.34 2.82 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.878 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -50.42 -56.85 9.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.647 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.618 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -63.8 -24.99 67.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.18 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.44 -57.62 11.46 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.659 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.2 OUTLIER -68.96 -54.49 15.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.588 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.498 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.3 tt0 -47.78 -28.75 2.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.031 0.443 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.987 HD21 HG22 ' A' ' 57' ' ' VAL . 3.0 tp -69.81 -38.37 76.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.197 -179.733 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -63.62 -58.2 7.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -50.66 -27.95 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.29 -179.854 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -70.56 -28.43 64.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.862 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.0 mt -74.07 -31.94 31.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.99 0.424 . . . . 0.0 110.58 179.614 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -67.86 -35.83 79.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.327 179.516 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -71.59 -29.37 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 179.568 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.614 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.1 mt . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.921 -179.984 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.556 HG22 HD22 ' A' ' 44' ' ' LEU . 25.1 t -54.89 -24.02 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.387 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -71.17 -29.44 65.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.013 -179.985 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.8 tptt -71.17 -57.26 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.89 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.614 ' CG2' HD11 ' A' ' 44' ' ' LEU . 25.0 t -55.49 -27.66 21.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.936 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.97 -31.84 73.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 110.649 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -79.55 -27.77 41.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -68.87 -28.73 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.319 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.987 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.1 -25.52 8.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.15 -28.53 60.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.442 -179.66 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -40.46 52.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.742 -179.149 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.783 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -76.2 -25.1 54.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.589 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -55.96 9.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.21 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.52 -26.79 68.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -60.59 -50.01 75.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.992 -179.919 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.617 HG12 HD13 ' A' ' 30' ' ' LEU . 14.2 mt -68.19 -22.79 27.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.784 179.452 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -38.74 67.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.383 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 mttp . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 120.977 0.418 . . . . 0.0 110.733 -179.979 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.831 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 . . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -78.05 -33.48 50.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.556 -179.397 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -19.8 56.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.77 0.319 . . . . 0.0 111.67 -179.743 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -47.38 23.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.796 -179.166 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.628 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.6 t -74.79 -29.12 22.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.907 -179.264 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 ttpp -63.25 -36.25 83.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.324 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.52 -23.86 37.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.57 0.7 . . . . 0.0 109.753 178.722 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.612 HD21 HD23 ' A' ' 60' ' ' LEU . 1.6 tt -68.07 -25.12 65.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.211 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.414 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.1 tt0 -75.0 -51.88 12.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.495 -179.4 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -50.2 -26.98 5.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.322 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -43.87 41.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.21 179.976 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.629 HG22 HD13 ' A' ' 64' ' ' ILE . 21.3 t -76.12 -48.12 29.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.556 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.414 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -49.59 -31.7 11.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.518 -179.552 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.13 -11.04 39.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.505 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.48 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.99 -179.869 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 N-CA-C 112.573 -0.211 . . . . 0.0 112.573 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -53.22 60.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.901 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.48 HG12 HD13 ' A' ' 21' ' ' LEU . 12.4 mt -60.21 -29.48 44.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.628 -179.473 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -59.09 -56.22 24.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.651 -179.265 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -58.45 -36.89 74.37 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.923 0.392 . . . . 0.0 111.225 -179.574 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.86 HD23 ' HG ' ' A' ' 60' ' ' LEU . 6.5 mt -66.77 -21.79 66.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.887 -179.387 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 tttm -78.63 -59.54 2.74 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.831 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -37.41 56.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -178.921 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.766 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.8 ttpm? -82.25 -24.67 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.204 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.84 -57.81 7.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.494 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -40.85 77.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.67 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.5 tt0 -59.74 -27.78 66.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.13 0.49 . . . . 0.0 110.659 179.869 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 1.061 HD21 HG22 ' A' ' 57' ' ' VAL . 6.8 tp -75.81 -40.02 55.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.66 -179.234 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.81 -33.23 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.842 -179.311 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 4.2 ptmt -79.05 -30.45 44.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.058 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -63.28 -26.0 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.893 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.3 mt -73.55 -30.08 28.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.622 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.7 -35.63 75.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.435 179.519 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -71.71 -28.8 63.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.479 179.603 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.69 HD13 HG23 ' A' ' 50' ' ' VAL . 5.3 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.988 179.985 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.69 HG23 HD13 ' A' ' 44' ' ' LEU . 14.4 p -54.16 -30.04 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.308 -179.925 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -33.46 74.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.061 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -57.29 12.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.864 -179.837 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.534 ' O ' HG23 ' A' ' 57' ' ' VAL . 39.7 t -55.11 -26.08 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.109 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.78 -34.35 77.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.025 0.441 . . . . 0.0 110.373 179.588 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -76.3 -28.16 56.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.469 179.583 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.23 -28.76 68.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.881 179.826 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 1.061 HG22 HD21 ' A' ' 37' ' ' LEU . 4.5 t -81.81 -25.42 9.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.898 179.885 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.7 -28.47 61.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.263 -179.852 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -74.51 -38.69 62.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.738 -179.373 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.86 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.0 tt -76.58 -26.01 54.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.343 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.36 -56.26 9.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.01 0.433 . . . . 0.0 110.289 179.82 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -61.85 -26.64 68.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.36 179.242 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.805 ' CB ' HD21 ' A' ' 30' ' ' LEU . 3.2 mm-40 -61.16 -45.0 96.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 14.8 mt -68.48 -23.76 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.023 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -34.34 76.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mtpm? . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.6 179.838 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -149.3 -47.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.8 -72.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.97 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.19 -42.76 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.331 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -57.67 -30.49 65.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.047 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -83.18 -25.75 31.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.335 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.577 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER -61.94 -46.99 86.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.627 -179.463 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.01 -32.84 73.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.961 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.497 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 2.5 pt-20 -77.44 -19.96 55.25 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -50.14 19.09 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 57' ' ' VAL . 25.8 t -74.83 -29.26 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -36.57 81.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -24.22 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.535 0.683 . . . . 0.0 109.547 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.94 -25.11 66.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.954 179.507 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.423 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.9 tt0 -77.67 -44.46 27.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.168 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -52.31 -27.28 14.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -53.19 8.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.225 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.648 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.3 t -64.8 -52.03 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.312 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 12.1 mttt -52.23 -25.65 9.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.448 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.61 -11.04 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.562 HD11 HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.84 -156.59 0.1 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.526 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.443 ' H ' HD22 ' A' ' 21' ' ' LEU . . . 178.86 148.96 7.92 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.542 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.04 160.96 23.64 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.539 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 -169.79 34.62 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.466 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.25 -111.43 4.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.533 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.416 ' HG2' HD22 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -69.49 -27.75 65.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.776 0.322 . . . . 0.0 111.034 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.408 HG12 HD13 ' A' ' 21' ' ' LEU . 33.1 mt -72.73 -29.53 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.442 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -56.17 12.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.804 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.61 -35.98 77.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 111.483 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.666 ' O ' HD11 ' A' ' 60' ' ' LEU . 83.6 mt -71.1 -21.48 62.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.944 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -76.37 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 mttm -54.04 -43.04 69.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.352 . . . . 0.0 111.496 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -72.54 -25.11 61.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.695 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.85 -57.77 8.83 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.805 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.18 -49.15 62.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 33' ' ' LYS . 11.9 pt-20 -54.32 -28.55 43.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 0.0 110.989 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.049 HD21 HG22 ' A' ' 57' ' ' VAL . 8.1 tp -67.72 -41.98 82.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.064 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -58.21 9.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.287 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptpm? -51.11 -28.02 9.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.318 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -70.91 -25.9 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.577 HD13 HD22 ' A' ' 7' ' ' LEU . 6.8 mt -77.84 -30.54 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.824 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -67.45 -41.03 85.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.588 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.422 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.9 pt-20 -66.84 -35.42 80.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.513 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.763 HD11 ' CG2' ' A' ' 53' ' ' VAL . 10.9 mt -55.31 170.56 0.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.113 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -117.81 -112.06 2.57 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.424 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.7 -45.18 1.06 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.495 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -147.59 -175.2 20.17 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.494 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.25 -99.99 2.47 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.489 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -62.95 -18.01 62.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.703 0.287 . . . . 0.0 111.205 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 18.3 t -55.37 -22.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.504 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -72.33 -36.08 68.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.097 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -64.83 -57.41 8.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.961 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.763 ' CG2' HD11 ' A' ' 44' ' ' LEU . 28.0 t -57.96 -26.28 28.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.27 -37.32 87.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 110.414 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -71.85 -28.18 63.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.577 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -68.78 -29.46 67.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.872 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.049 HG22 HD21 ' A' ' 37' ' ' LEU . 19.7 t -83.25 -25.55 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.026 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -73.83 -28.26 61.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.522 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -75.37 -44.0 47.34 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.666 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.02 -25.12 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.01 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -70.43 -55.3 9.36 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.055 0.455 . . . . 0.0 110.752 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -62.22 -26.81 68.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.214 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -56.74 14.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.413 -179.5 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.785 HG23 HD11 ' A' ' 67' ' ' LEU . 21.5 mt -58.19 -24.57 24.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.345 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -31.76 58.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.515 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -106.99 -68.1 0.91 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 111.364 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.785 HD11 HG23 ' A' ' 64' ' ' ILE . 97.5 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.95 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.648 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.529 -0.228 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m -135.98 159.0 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.865 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -176.49 -39.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.963 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.528 HG22 HG21 ' A' ' 50' ' ' VAL . 21.4 t -79.78 -28.63 12.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.239 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -68.39 -29.54 68.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.93 0.395 . . . . 0.0 110.724 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.12 -25.47 31.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -49.55 66.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.536 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -61.51 -34.83 76.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.884 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.1 -19.57 56.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.722 0.296 . . . . 0.0 111.604 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.8 -44.51 63.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.671 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.578 HG22 ' CG1' ' A' ' 57' ' ' VAL . 19.3 t -79.1 -29.05 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.913 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -36.53 83.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.248 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.68 -26.66 34.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.545 0.688 . . . . 0.0 109.565 178.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.57 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -64.28 -25.15 67.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.09 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.403 ' HG2' ' CG ' ' A' ' 19' ' ' LYS . 1.2 tm-20 -76.85 -56.06 4.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.341 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.07 -27.91 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.491 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -76.03 -41.62 50.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.345 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.661 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 22.1 t -76.13 -48.59 27.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.523 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.403 ' CG ' ' HG2' ' A' ' 15' ' ' GLU . 1.7 mtpt -49.16 -32.89 11.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.348 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -11.0 43.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.591 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.74 HD23 ' H ' ' A' ' 22' ' ' GLY . 0.3 OUTLIER -65.44 164.71 13.31 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.83 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.74 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -139.77 120.6 1.86 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.513 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 147.85 -176.13 26.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.555 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.89 -179.34 16.53 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.484 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.41 -91.2 0.74 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.471 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.494 ' CD ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -54.54 -60.28 3.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.906 0.384 . . . . 0.0 111.05 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.534 ' HA ' HD12 ' A' ' 30' ' ' LEU . 4.1 mt -55.0 -29.64 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.501 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -56.26 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.293 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.39 -28.95 63.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.9 0.381 . . . . 0.0 110.957 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.926 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.2 mt -74.54 -21.56 59.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.539 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.11 -59.2 2.88 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.05 -42.39 49.68 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -80.88 -25.21 37.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.901 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.19 -57.57 12.23 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.687 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.83 -55.73 15.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.459 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.501 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.4 tt0 -47.94 -28.39 2.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.039 0.447 . . . . 0.0 111.246 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.02 HD21 HG22 ' A' ' 57' ' ' VAL . 12.1 tp -71.41 -38.29 71.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.454 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HD2' HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -64.81 -58.28 6.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.536 -179.46 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -27.8 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.348 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 1.8 tptt -70.38 -25.58 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.239 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.63 -37.26 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.839 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.25 -29.71 69.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.779 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 4.4 pt-20 -78.4 -30.51 47.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.559 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.784 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.4 mt -59.61 162.63 4.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.037 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -105.81 -46.8 1.16 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 135.84 69.29 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.596 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 133.21 145.81 5.45 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.536 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.37 -64.56 4.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.562 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.784 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.1 tt0 -95.07 -22.84 17.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.755 0.312 . . . . 0.0 110.986 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.528 HG21 HG22 ' A' ' 4' ' ' VAL . 14.9 p -52.85 -29.39 14.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.427 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.85 87.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.082 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -60.03 -57.09 14.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.066 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.616 ' CG2' HD11 ' A' ' 44' ' ' LEU . 24.4 t -55.79 -25.87 19.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.24 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.84 -37.84 87.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.35 . . . . 0.0 110.556 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.07 -27.98 63.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.795 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -70.61 -28.89 65.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.02 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.25 -25.56 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.054 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -28.64 60.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.4 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -39.67 54.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.926 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.5 tt -75.14 -25.25 58.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.481 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -56.1 8.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.951 0.405 . . . . 0.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.93 -26.96 67.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.869 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.2 mt-10 -61.66 -46.76 88.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 30' ' ' LEU . 17.2 mt -65.26 -24.2 34.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.01 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.31 -31.77 72.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.911 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -64.42 -61.12 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.598 HD21 ' HA ' ' A' ' 64' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.087 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.661 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.241 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -85.57 -177.99 6.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -172.12 -42.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.866 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.78 -28.16 40.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.237 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 pttm -58.74 -34.97 71.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.87 -25.57 53.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.104 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.11 -28.84 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.117 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.501 ' CG ' HG21 ' A' ' 41' ' ' ILE . 20.8 mt-10 -81.93 -43.35 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.364 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -66.41 -19.87 65.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.423 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.67 -53.98 9.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.302 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.472 HG22 ' CG1' ' A' ' 57' ' ' VAL . 36.8 t -60.56 -29.23 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.723 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -37.23 74.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.8 40.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.47 0.653 . . . . 0.0 109.522 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 60' ' ' LEU . 1.3 tt -65.51 -25.12 67.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.915 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.4 tt0 -75.28 -46.43 33.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.098 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.22 -27.71 23.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -41.31 50.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.088 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.677 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 25.3 t -78.14 -51.78 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.579 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -49.82 -31.1 11.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.49 -179.559 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -11.59 38.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.464 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.864 HD11 HD13 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -65.11 -69.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.997 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 76.77 142.39 1.38 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.448 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.0 -165.09 24.39 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.528 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.35 144.86 15.06 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.513 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.01 -93.32 0.77 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.611 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.48 ' HB3' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.37 -55.47 20.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.041 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.591 HD12 ' H ' ' A' ' 27' ' ' ILE . 4.6 mp -58.5 -29.67 39.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.717 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -56.21 21.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 0.0 111.299 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -26.82 64.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.191 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.884 HD23 ' HG ' ' A' ' 60' ' ' LEU . 5.6 mt -76.66 -21.68 55.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -78.56 -59.35 2.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -39.21 58.32 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.657 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -81.9 -24.96 35.39 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.07 -57.71 10.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.668 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -46.45 71.69 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -53.83 -28.17 34.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 0.0 110.835 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.107 HD21 HG22 ' A' ' 57' ' ' VAL . 8.7 tp -72.03 -41.78 67.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.388 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -58.18 9.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.538 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt -52.96 -28.54 24.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.351 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.414 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -69.15 -29.89 68.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.103 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.501 HG21 ' CG ' ' A' ' 8' ' ' GLU . 8.0 mt -74.47 -31.76 28.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.872 0.368 . . . . 0.0 110.671 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -68.83 -31.95 71.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.534 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -75.26 -29.65 60.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.679 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.559 HD22 HG22 ' A' ' 50' ' ' VAL . 6.1 mt -59.95 170.84 1.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.969 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.87 -72.86 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.548 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 175.16 42.0 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.544 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.35 -124.39 5.29 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.501 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -108.47 -29.43 4.2 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.406 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.86 -18.94 61.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.63 0.252 . . . . 0.0 111.117 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.559 HG22 HD22 ' A' ' 44' ' ' LEU . 21.2 t -51.53 -28.04 8.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.796 0.332 . . . . 0.0 111.454 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.74 -29.46 62.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.979 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -63.28 -57.17 11.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 34.5 t -61.12 -29.72 46.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.16 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -63.21 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.703 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -79.06 -27.67 43.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.895 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -69.27 -28.54 66.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.379 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.107 HG22 HD21 ' A' ' 37' ' ' LEU . 7.2 t -83.22 -25.87 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.116 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -75.23 -28.61 59.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -37.85 56.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.676 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.884 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.6 tt -76.93 -25.78 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.118 -0.233 . . . . 0.0 111.439 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.36 -56.08 9.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.988 0.423 . . . . 0.0 110.28 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -62.25 -26.78 68.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.776 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.852 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -60.27 -47.57 85.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.019 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.733 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.4 mt -66.37 -24.01 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.111 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -63.13 -33.99 76.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -65.35 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.717 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.864 HD13 HD11 ' A' ' 21' ' ' LEU . 3.3 pp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.085 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.677 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.6 m -69.28 101.97 1.62 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.867 0.365 . . . . 0.0 110.849 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.65 -43.66 2.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.882 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.46 -38.5 46.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.143 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tmtm? -57.47 -28.44 63.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 9' ' ' GLU . . . -78.71 -25.09 44.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.186 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.48 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -71.79 -33.53 68.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.496 -179.465 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -83.06 -32.82 26.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.737 0.303 . . . . 0.0 111.404 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 12' ' ' LYS . 2.3 pp20? -76.2 -19.16 58.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.199 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.87 -46.97 14.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.009 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.64 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.9 t -72.51 -29.51 31.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 9' ' ' GLU . 18.1 ptpt -63.11 -35.42 80.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.934 0.397 . . . . 0.0 110.358 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.5 -23.76 37.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.496 0.665 . . . . 0.0 109.572 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 60' ' ' LEU . 2.4 tt -67.4 -25.22 65.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.004 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.419 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 26.9 tt0 -77.2 -48.47 17.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.247 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.38 -25.88 10.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.188 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -76.06 -45.2 35.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.633 HG22 HD13 ' A' ' 64' ' ' ILE . 2.3 t -75.77 -51.04 21.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.458 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 16.3 mttt -52.2 -30.43 27.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.26 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.0 -11.45 35.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.287 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.828 HD11 HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -72.34 -70.06 0.36 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.028 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.13 -102.61 0.34 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.508 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 159.26 122.2 0.65 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.518 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -164.74 28.67 0.21 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.798 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.56 -103.48 0.48 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.836 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.909 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -51.44 -27.91 11.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 111.289 -179.865 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.419 ' HA ' HD12 ' A' ' 30' ' ' LEU . 59.9 mt -64.59 -29.82 48.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.167 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -59.75 -56.02 26.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.338 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.42 -36.72 71.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 0.0 111.282 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.962 HD23 ' HG ' ' A' ' 60' ' ' LEU . 7.1 mt -67.1 -21.86 65.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.643 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -78.54 -59.1 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -51.89 -59.09 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.816 0.341 . . . . 0.0 111.914 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.451 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -59.92 -24.99 64.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.698 -179.458 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.03 -57.75 11.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -67.25 -55.47 13.86 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.561 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.8 OUTLIER -47.98 -28.27 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 0.0 111.18 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 57' ' ' VAL . 10.8 tp -70.51 -41.33 72.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.342 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -58.27 9.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.548 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 10.8 ptmt -52.46 -27.98 18.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.242 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -71.07 -25.82 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.053 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.7 mt -74.07 -31.85 31.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.862 0.363 . . . . 0.0 110.67 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -67.95 -33.56 74.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.335 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -74.66 -28.59 60.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.737 179.612 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB ' ' A' ' 53' ' ' VAL . 7.8 mt -58.66 173.23 0.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.108 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -129.72 -81.96 0.28 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.558 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -151.79 -43.73 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.523 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -144.29 149.14 21.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.597 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.1 -74.06 0.26 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.524 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -95.03 -23.3 17.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.728 0.299 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 p -49.46 -27.19 2.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.691 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -26.06 61.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.414 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -77.96 -57.39 3.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.206 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.622 ' O ' HG23 ' A' ' 57' ' ' VAL . 22.3 t -57.5 -25.89 25.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.325 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -38.03 86.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 110.652 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.03 -27.79 62.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -72.06 -28.7 63.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.438 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.23 -27.35 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.224 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -28.71 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.76 -39.08 52.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.939 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.962 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -78.14 -24.94 47.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.632 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -70.43 -54.27 13.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.985 0.422 . . . . 0.0 110.205 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -64.03 -26.85 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.635 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.917 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.6 mm-40 -59.37 -57.7 11.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.834 ' CG1' HD22 ' A' ' 30' ' ' LEU . 29.6 mt -56.14 -25.6 20.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.24 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -28.09 65.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.82 -37.45 70.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.017 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.909 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.953 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.604 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.75 -30.83 6.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.771 0.319 . . . . 0.0 110.983 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -59.88 -64.55 0.91 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.78 HG22 HG21 ' A' ' 50' ' ' VAL . 21.3 t -72.78 -42.32 61.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.347 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -31.64 63.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.937 0.399 . . . . 0.0 110.963 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -83.17 -25.77 31.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.253 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.47 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -63.24 -34.71 78.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 -179.748 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -68.08 -34.14 75.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.295 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 1.5 pt-20 -77.06 -19.79 56.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.409 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -42.74 67.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.346 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.442 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.1 t -78.4 -29.31 14.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.6 81.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.043 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.9 37.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.539 0.685 . . . . 0.0 109.59 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.596 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -66.99 -25.33 66.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.905 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.13 -50.7 11.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.091 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -49.42 -27.46 4.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.135 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -76.04 -40.54 53.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.907 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.669 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 16.0 t -78.32 -55.3 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -55.2 -22.08 16.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.64 -16.09 27.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.408 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.581 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp -102.84 158.54 16.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.89 0.376 . . . . 0.0 110.817 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.504 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -133.11 171.79 21.68 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.597 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.47 -134.78 5.65 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.427 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.581 ' N ' HD12 ' A' ' 27' ' ' ILE . . . -179.21 153.52 12.49 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.527 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.14 -103.8 2.86 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.568 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -27.76 64.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 111.018 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.581 HD12 ' N ' ' A' ' 24' ' ' GLY . 49.4 mt -68.06 -29.8 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.219 -179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.51 -56.12 21.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.178 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.57 -29.51 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.837 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.001 HD21 ' HB3' ' A' ' 63' ' ' GLU . 9.5 mt -72.08 -22.28 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.325 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -78.61 -59.16 2.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -58.87 5.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.794 0.331 . . . . 0.0 111.838 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.744 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.5 ttpm? -60.37 -25.05 65.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.75 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.38 -57.57 11.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.639 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.36 -55.44 10.4 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.546 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.01 -28.62 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.006 0.431 . . . . 0.0 111.141 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.109 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.02 -38.24 75.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.165 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -58.02 8.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.375 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptmt -50.25 -31.78 14.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.378 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.407 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 38.2 tttp -66.76 -25.98 66.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 mt -74.13 -32.41 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 0.0 110.625 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -67.35 -36.34 81.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -71.02 -29.78 65.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.483 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.671 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.1 mt -61.76 166.35 4.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.72 -96.25 0.22 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.53 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.55 -141.48 11.51 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.496 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.53 157.06 28.54 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.599 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 124.75 -68.44 0.5 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HB3' HD21 ' A' ' 44' ' ' LEU . 7.8 tt0 -95.1 -22.72 17.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.794 0.331 . . . . 0.0 111.005 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.78 HG21 HG22 ' A' ' 4' ' ' VAL . 14.3 p -50.1 -28.33 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.53 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.62 -31.55 67.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.068 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -66.42 -57.25 7.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.671 ' CG2' HD11 ' A' ' 44' ' ' LEU . 18.0 t -58.99 -25.9 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.126 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -38.36 89.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -71.71 -27.88 63.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.638 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -69.75 -28.94 66.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.928 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.109 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.49 -25.45 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.046 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -74.58 -28.38 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.437 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.61 -43.44 48.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.503 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.937 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -72.51 -25.04 61.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.59 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -69.76 -56.14 7.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.936 0.398 . . . . 0.0 110.557 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.49 -26.94 65.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.807 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 1.001 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.32 -48.41 78.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.943 -179.925 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.671 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.6 mt -65.75 -24.16 33.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.861 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -35.33 76.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.989 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -62.68 -58.54 7.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.568 HD11 HG23 ' A' ' 64' ' ' ILE . 3.3 pp . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.929 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.669 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.531 -0.228 . . . . 0.0 112.531 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m -153.26 110.28 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.884 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -176.5 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.2 p -73.83 -28.33 24.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.173 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -35.78 66.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.854 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.48 -25.91 54.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.96 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.917 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -66.64 -27.94 68.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.521 ' HG3' HG21 ' A' ' 41' ' ' ILE . 58.1 mt-10 -78.68 -32.57 47.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.639 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -20.47 56.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -74.81 -55.04 6.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.897 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.705 HG22 HG13 ' A' ' 57' ' ' VAL . 12.1 t -63.91 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.267 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -59.23 -36.84 76.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.438 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.407 ' HB1' ' OE2' ' A' ' 16' ' ' GLU . . . -78.95 -23.89 44.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.531 0.682 . . . . 0.0 109.414 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.599 HD21 HD23 ' A' ' 60' ' ' LEU . 2.3 tt -66.85 -24.99 66.2 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.856 -1.066 . . . . 0.0 110.86 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.428 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 34.3 tt0 -74.19 -49.77 22.11 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.63 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.407 ' OE2' ' HB1' ' A' ' 13' ' ' ALA . 1.1 pt-20 -50.71 -26.02 5.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.757 0.313 . . . . 0.0 111.341 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -75.11 -43.91 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.173 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.647 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.0 t -77.94 -56.26 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.334 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 22.2 mttt -51.82 -24.11 5.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.301 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.52 -18.81 28.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.142 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.585 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp -102.64 159.34 15.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.808 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.519 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -145.84 145.29 14.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.26 -128.17 1.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.428 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -173.76 155.35 21.83 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.461 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.19 -103.59 3.07 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.556 ' HG3' ' HA ' ' A' ' 67' ' ' LEU . 0.2 OUTLIER -56.56 -27.63 58.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.104 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.409 HD13 ' CD1' ' A' ' 21' ' ' LEU . 61.4 mt -74.19 -29.69 25.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.502 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -56.15 15.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.759 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -61.19 -37.58 83.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.625 HD21 ' HB3' ' A' ' 63' ' ' GLU . 71.5 mt -67.54 -21.41 65.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.801 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -78.03 -59.29 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -53.59 -34.8 59.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.748 0.308 . . . . 0.0 111.777 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.02 -24.78 35.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.823 -179.404 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.96 -58.0 8.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -46.4 68.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.876 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -55.05 -28.17 50.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.057 0.456 . . . . 0.0 110.789 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.981 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.33 -42.44 75.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.328 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -58.17 9.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.4 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -49.97 -32.8 15.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.444 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -66.46 -26.84 67.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.521 HG21 ' HG3' ' A' ' 8' ' ' GLU . 8.4 mt -74.81 -32.39 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.569 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.65 -33.18 74.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.413 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.42 -29.79 61.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.509 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.581 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.8 mt -60.18 -175.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.971 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.22 -56.92 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.466 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.81 46.49 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.529 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.47 151.06 5.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.523 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.52 -80.2 1.4 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.467 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -95.14 -17.58 21.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.699 0.285 . . . . 0.0 111.027 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.74 -29.56 7.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.482 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -66.17 -31.0 71.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.029 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.2 tptp -66.33 -57.25 7.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.588 ' O ' HG23 ' A' ' 57' ' ' VAL . 44.8 t -55.49 -26.01 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.202 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.93 -36.58 84.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.57 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -73.79 -27.84 61.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.723 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -69.53 -28.69 66.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.981 HG22 HD21 ' A' ' 37' ' ' LEU . 10.2 t -82.76 -25.71 8.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.115 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.35 -28.38 59.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.597 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.08 -41.19 62.08 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.12 -26.17 47.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.942 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -71.54 -42.22 68.17 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.962 0.41 . . . . 0.0 110.735 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 65' ' ' LYS . 4.4 tt0 -74.26 -26.38 60.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.625 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -64.38 -59.2 4.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.405 -179.531 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.735 ' HA ' HD12 ' A' ' 67' ' ' LEU . 37.9 mt -51.29 -26.58 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.044 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 2.4 mptp? -52.9 -38.72 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -95.6 -67.36 0.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 64' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.947 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.647 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.474 -0.251 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 p -110.99 111.79 23.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.855 0.36 . . . . 0.0 110.934 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -115.23 -66.79 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -81.15 -41.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.016 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -32.97 62.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.581 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -73.05 -25.65 61.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.875 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.55 -33.34 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -74.48 -30.4 61.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.496 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.507 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 pt-20 -77.01 -24.77 52.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -52.5 38.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.813 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.626 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.3 t -67.06 -29.21 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.351 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.06 75.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.78 -24.48 38.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 109.56 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.585 HD21 HD23 ' A' ' 60' ' ' LEU . 1.9 tt -64.99 -24.94 67.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.941 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.422 ' HG2' ' HG3' ' A' ' 19' ' ' LYS . 0.6 OUTLIER -77.38 -55.34 5.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.607 -179.122 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -46.8 -27.72 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.513 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -76.1 -40.5 52.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.313 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.679 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 13.1 t -78.19 -45.48 26.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.484 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG3' ' HG2' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -49.22 -29.91 6.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.495 -179.413 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.55 -13.23 37.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.472 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.743 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -69.12 -69.7 0.32 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.978 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 122.35 -83.04 0.35 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.419 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.02 147.01 6.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.43 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.679 ' N ' HD12 ' A' ' 27' ' ' ILE . . . -164.14 32.41 0.26 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.11 -78.53 1.93 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.519 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.591 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.96 -28.13 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 0.0 110.771 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.744 HG12 HD22 ' A' ' 67' ' ' LEU . 12.5 mt -67.78 -29.72 46.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.243 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -52.78 60.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.108 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -57.64 -30.39 65.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.923 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.979 HD23 ' HG ' ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.5 -21.86 61.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.306 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -78.09 -59.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.998 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.75 69.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.823 0.344 . . . . 0.0 111.809 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.576 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -71.55 -24.94 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.809 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.93 -57.96 8.99 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.631 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -47.07 66.87 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -28.09 49.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.096 0.474 . . . . 0.0 110.844 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.046 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -72.92 -39.0 66.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.431 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -53.08 62.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.451 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -27.99 68.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.384 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 6.5 tptm -67.09 -27.14 67.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.281 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.47 -33.59 23.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.881 0.372 . . . . 0.0 110.666 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.45 -31.46 72.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.21 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -77.11 -29.41 54.81 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.441 179.644 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.701 HD11 ' CG2' ' A' ' 53' ' ' VAL . 23.6 mt -60.93 175.44 0.5 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.002 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.28 -95.82 1.05 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.403 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -157.12 25.75 0.48 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 163.47 160.84 11.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.499 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.09 -92.58 1.65 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.538 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.17 -21.19 29.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.705 0.288 . . . . 0.0 111.201 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.497 HG13 HD13 ' A' ' 44' ' ' LEU . 29.3 t -53.34 -27.89 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.396 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -28.54 67.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.044 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.25 -57.17 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.936 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.701 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.5 t -52.47 -27.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.481 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -63.27 -30.99 72.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.983 0.421 . . . . 0.0 110.687 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -80.97 -27.83 35.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.831 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -67.95 -28.72 67.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.046 HG22 HD21 ' A' ' 37' ' ' LEU . 21.2 t -81.05 -25.84 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.969 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.01 -28.42 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.332 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.25 -37.15 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.979 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.0 tt -76.08 -28.67 57.67 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.087 -0.245 . . . . 0.0 111.393 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.5 -56.13 12.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.917 0.389 . . . . 0.0 110.652 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -62.26 -26.79 68.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.841 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.854 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -61.82 -43.19 99.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.028 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.893 HG12 HD22 ' A' ' 30' ' ' LEU . 17.5 mt -65.72 -24.53 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.208 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.1 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.888 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.73 -61.55 2.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.831 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.744 HD22 HG12 ' A' ' 27' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.073 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.679 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t -134.05 119.39 18.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.929 0.395 . . . . 0.0 110.861 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -176.23 -60.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.898 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.3 p -67.17 -27.82 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.172 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -54.76 -34.78 63.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.89 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.46 -25.86 41.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.0 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.035 HD21 HG21 ' A' ' 57' ' ' VAL . 0.8 OUTLIER -62.03 -30.21 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.119 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.44 -33.11 66.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.381 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -19.6 56.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.534 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.12 -43.2 24.55 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.633 HG22 ' CG1' ' A' ' 57' ' ' VAL . 17.6 t -76.91 -29.39 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -63.07 -35.24 79.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.973 0.416 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.28 -26.76 35.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.606 0.717 . . . . 0.0 109.503 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' HG23 ' A' ' 18' ' ' VAL . 2.7 tt -63.15 -25.46 68.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.814 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.6 tt0 -76.86 -45.11 29.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.196 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.43 -29.03 22.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.143 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -45.95 30.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.643 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.9 t -70.87 -51.57 34.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.527 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -50.33 -31.01 13.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.364 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.2 -13.33 38.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.387 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.868 HD22 HD11 ' A' ' 27' ' ' ILE . 0.6 OUTLIER -65.11 -69.07 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.546 ' C ' HD13 ' A' ' 27' ' ' ILE . . . 149.59 -124.93 1.88 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.468 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.44 ' N ' HD13 ' A' ' 27' ' ' ILE . . . -163.81 165.29 36.87 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.499 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 147.9 -115.41 0.75 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.494 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -103.92 -56.01 0.76 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.512 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.49 -62.03 2.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.868 HD11 HD22 ' A' ' 21' ' ' LEU . 10.6 mt -51.04 -29.15 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.952 -179.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -60.04 -56.35 22.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -56.61 19.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.979 0.419 . . . . 0.0 111.365 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.936 HD13 HG12 ' A' ' 64' ' ' ILE . 37.5 mt -53.01 -21.02 3.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.467 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.9 -59.25 2.86 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -39.15 58.64 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.749 ' HD3' HD12 ' A' ' 60' ' ' LEU . 34.7 tttp -80.77 -24.67 38.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.282 -0.417 . . . . 0.0 112.12 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.3 -57.77 9.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.649 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -47.76 66.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.036 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.43 -28.19 42.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.064 0.459 . . . . 0.0 110.973 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.014 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.39 -41.71 72.66 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.313 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -58.98 -58.08 10.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.352 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.31 -28.02 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.41 -26.31 63.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.033 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -74.22 -32.55 32.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.969 0.414 . . . . 0.0 110.628 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.61 -33.98 76.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.515 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -73.72 -29.26 62.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.646 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.737 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.2 mt -58.96 161.79 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.979 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -112.58 -75.13 0.71 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.553 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 168.97 57.51 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.561 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 138.89 144.65 4.64 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.546 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.28 -76.28 1.0 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.559 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -95.1 -20.04 19.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.701 0.286 . . . . 0.0 111.037 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -48.91 -30.64 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.447 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -29.9 65.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.917 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -66.71 -57.19 7.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.878 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.737 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.6 t -56.57 -29.51 29.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.141 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.645 ' HA ' HD11 ' A' ' 7' ' ' LEU . 19.6 tt0 -62.25 -33.59 74.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.623 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -76.85 -28.01 55.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.786 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -67.58 -28.82 68.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.965 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.035 HG21 HD21 ' A' ' 7' ' ' LEU . 11.9 t -83.03 -25.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.998 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -74.11 -28.21 61.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.486 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.54 -41.45 54.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.749 HD12 ' HD3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -76.91 -25.73 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.505 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.45 -53.96 14.26 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.991 0.424 . . . . 0.0 110.628 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -64.39 -26.89 68.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.185 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.4 mm-40 -61.9 -59.08 5.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.258 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.936 HG12 HD13 ' A' ' 30' ' ' LEU . 33.5 mt -54.28 -25.45 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.667 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -53.0 -38.64 62.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.724 0.297 . . . . 0.0 111.438 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.6 mttp -99.99 -67.18 0.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.864 0.364 . . . . 0.0 110.951 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.775 ' CD1' HD11 ' A' ' 21' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.864 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.643 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 m -145.86 -47.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.922 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -161.79 -44.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.36 -33.94 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.172 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.7 -30.95 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.528 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -81.91 -25.69 34.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.215 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.72 -35.81 80.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -72.44 -31.34 65.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.596 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.528 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 4.4 pt-20 -77.25 -21.92 52.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.725 0.298 . . . . 0.0 111.378 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -54.98 9.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.235 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 57' ' ' VAL . 22.7 t -67.76 -29.21 44.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.419 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -59.5 -36.65 76.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.634 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.03 -23.99 38.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.6 0.714 . . . . 0.0 109.541 178.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.567 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.24 -25.23 67.58 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.819 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HG3' ' HG3' ' A' ' 19' ' ' LYS . 26.9 tt0 -75.84 -46.02 32.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.012 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -53.17 -27.1 19.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.207 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -49.19 18.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.689 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 18.7 t -70.08 -55.2 15.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.376 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 6.2 mtpt -52.67 -24.53 8.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.492 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.92 -19.12 26.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.897 HD12 HG21 ' A' ' 27' ' ' ILE . 1.6 tm? -78.66 146.92 33.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.248 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.778 ' H ' HD22 ' A' ' 21' ' ' LEU . . . -56.01 -97.02 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.642 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -173.91 -179.91 44.86 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.664 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.22 -160.66 29.02 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.484 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -83.5 -57.89 2.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.437 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -61.41 2.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.014 0.435 . . . . 0.0 110.922 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.897 HG21 HD12 ' A' ' 21' ' ' LEU . 2.0 mp -51.75 -29.46 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.911 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -56.18 25.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.49 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.422 . . . . 0.0 110.962 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.933 HD22 ' CG1' ' A' ' 64' ' ' ILE . 2.4 mt -69.2 -21.27 63.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.618 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -77.72 -59.19 2.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -54.1 32.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.352 . . . . 0.0 111.583 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 9.3 tttp -65.1 -25.07 67.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.784 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.5 -57.53 12.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.08 -52.34 43.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.609 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.46 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.8 tm-20 -49.49 -28.38 5.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 111.106 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.03 HD21 HG22 ' A' ' 57' ' ' VAL . 9.7 tp -71.87 -41.89 67.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.58 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -58.29 9.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.707 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -33.02 9.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.636 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 tttt -67.85 -27.19 66.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.165 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -76.0 -31.49 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.868 0.366 . . . . 0.0 110.752 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -69.69 -31.41 69.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.6 pt-20 -76.05 -29.6 58.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.529 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 50' ' ' VAL . 8.3 mt -61.18 159.23 12.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.018 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.36 -82.15 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.567 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -89.28 -114.04 1.38 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.518 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.04 -170.92 12.82 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.581 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.43 -63.2 0.97 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.487 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -95.05 -24.52 16.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.768 0.318 . . . . 0.0 110.937 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.617 HG23 HD13 ' A' ' 44' ' ' LEU . 14.7 p -54.35 -28.73 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.351 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -66.06 -32.84 74.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.153 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -69.69 -57.34 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.994 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.4 t -52.87 -25.81 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.432 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -65.87 -38.06 87.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.719 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -72.06 -27.78 62.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.84 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.84 -29.11 65.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.136 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.03 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.28 -25.85 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.116 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -75.31 -28.5 59.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.51 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -38.59 55.91 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.929 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.0 -25.34 47.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.616 0.246 . . . . 0.0 111.627 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -54.18 15.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.065 0.459 . . . . 0.0 110.466 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 -26.84 68.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.923 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.85 -51.19 70.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.166 -179.746 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.933 ' CG1' HD22 ' A' ' 30' ' ' LEU . 19.4 mt -62.03 -24.64 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.114 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -66.07 -31.87 73.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.969 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -66.65 -59.59 3.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.564 HD21 ' HA ' ' A' ' 64' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.964 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.689 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -136.62 -178.6 5.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.838 0.351 . . . . 0.0 110.85 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 -40.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.44 -27.01 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.24 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.53 -38.84 64.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.868 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.6 -25.67 64.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.659 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -68.77 -29.18 67.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.168 -179.846 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -78.73 -39.98 34.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.323 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -19.97 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.381 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -53.76 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.192 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.579 HG22 ' CG1' ' A' ' 57' ' ' VAL . 31.6 t -64.31 -29.31 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.41 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -37.1 75.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.729 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 -23.93 41.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.511 0.672 . . . . 0.0 109.517 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.677 HD21 HD23 ' A' ' 60' ' ' LEU . 2.2 tt -65.22 -25.28 67.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.707 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.409 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 41.9 tt0 -79.09 -47.4 16.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -51.36 -30.64 19.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.899 0.381 . . . . 0.0 111.082 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.4 tttm -76.15 -38.04 57.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.675 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 20.0 t -78.12 -56.26 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.399 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.7 mtpp -52.74 -24.62 9.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.243 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -18.75 26.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.98 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.629 HD11 HG12 ' A' ' 27' ' ' ILE . 1.2 pp -103.29 159.24 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.551 ' HA2' HD13 ' A' ' 27' ' ' ILE . . . -171.31 152.32 17.74 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.641 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 114.87 95.52 2.06 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.539 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.87 157.12 8.58 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.548 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.89 -27.54 60.37 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.474 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.626 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.23 -37.27 72.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.864 0.364 . . . . 0.0 110.913 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.629 HG12 HD11 ' A' ' 21' ' ' LEU . 19.7 mt -63.41 -29.73 47.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.867 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.92 -56.18 17.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.628 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -27.09 67.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 63' ' ' GLU . 96.5 mt -76.83 -21.54 54.89 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.552 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -78.33 -59.35 2.82 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -53.34 -36.24 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 111.727 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.77 35.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.842 -179.265 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.8 -57.71 9.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -44.94 72.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.885 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 52.9 tt0 -55.34 -28.04 51.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.161 0.505 . . . . 0.0 110.776 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 6.1 tp -70.97 -42.2 70.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.337 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -57.96 -58.19 9.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.537 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 7.1 pttt -51.69 -28.36 14.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -70.74 -26.9 63.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.013 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.546 ' HA ' HD12 ' A' ' 44' ' ' LEU . 6.9 mt -77.73 -29.56 16.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.867 0.365 . . . . 0.0 110.749 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -38.98 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.423 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.434 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.7 pt-20 -68.17 -35.21 77.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.347 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.858 HD11 HG21 ' A' ' 53' ' ' VAL . 7.0 mt -54.08 179.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.024 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -145.69 -67.15 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.486 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.483 ' HA2' HG21 ' A' ' 50' ' ' VAL . . . 143.52 93.27 0.17 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.418 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.62 -37.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.649 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -169.89 -39.83 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.769 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.598 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 4.8 tt0 -65.76 -14.68 61.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.62 0.247 . . . . 0.0 111.533 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.483 HG21 ' HA2' ' A' ' 46' ' ' GLY . 21.5 t -64.78 -14.69 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.706 0.288 . . . . 0.0 111.234 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -52.92 11.43 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.598 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -54.81 -57.2 12.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 44' ' ' LEU . 16.5 t -55.66 -31.31 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.806 0.336 . . . . 0.0 111.246 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.659 ' HG2' HD11 ' A' ' 7' ' ' LEU . 2.1 tm-20 -61.95 -32.7 73.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -77.37 -27.74 52.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.841 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.02 -29.94 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 14.5 t -83.31 -25.56 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.179 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -28.18 61.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.376 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -37.83 59.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.757 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.677 HD23 HD21 ' A' ' 14' ' ' LEU . 1.1 tt -78.09 -25.7 47.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.759 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.29 -55.53 8.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 110.496 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.28 -26.89 68.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.919 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.865 ' HB3' HD21 ' A' ' 30' ' ' LEU . 5.1 mt-10 -62.58 -49.35 75.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.464 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.793 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -58.21 -27.75 33.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.075 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -67.35 -30.35 70.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.898 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -69.23 -53.62 18.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.843 HD21 HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.947 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.675 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.1 m -151.6 94.53 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -111.35 -45.82 3.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.7 t -75.96 -34.41 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.044 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -33.57 70.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.002 0.429 . . . . 0.0 110.618 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.4 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -72.49 -25.39 61.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.074 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.51 -38.21 74.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.596 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -74.53 -33.43 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.548 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.4 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -76.94 -19.72 57.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.21 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -42.79 47.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.143 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.9 t -74.12 -29.42 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.379 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -62.08 -36.02 80.41 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.347 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.22 -24.49 37.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.463 0.649 . . . . 0.0 109.54 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.55 HD21 HD23 ' A' ' 60' ' ' LEU . 1.4 tt -65.74 -25.24 67.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.745 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 35.6 tt0 -74.17 -40.31 62.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.167 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -53.63 -28.61 33.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.196 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 tptt -76.06 -43.8 42.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.754 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.4 t -73.97 -52.56 20.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.373 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.3 mttm -49.12 -31.71 8.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.321 . . . . 0.0 111.577 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.14 -12.28 61.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.828 HD22 ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -62.89 174.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.297 -179.843 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.828 ' N ' HD22 ' A' ' 21' ' ' LEU . . . -134.27 -59.67 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.459 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -150.41 135.25 5.13 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.514 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.32 -167.81 39.6 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.636 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -113.37 -66.52 0.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.5 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.26 -27.8 4.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.72 0.295 . . . . 0.0 111.229 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.697 HG21 ' HG ' ' A' ' 21' ' ' LEU . 55.6 mt -65.01 -29.95 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.441 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -62.22 -56.06 22.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -58.84 -27.0 64.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.894 0.378 . . . . 0.0 110.836 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.985 HD21 ' HB3' ' A' ' 63' ' ' GLU . 4.9 mt -73.71 -23.4 59.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.292 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -78.32 -59.43 2.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -36.98 45.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.671 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.93 35.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.022 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.43 -57.85 8.1 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -178.57 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -43.51 73.8 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.594 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.29 -28.2 64.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.029 0.442 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.139 HD21 HG22 ' A' ' 57' ' ' VAL . 6.4 tp -69.13 -48.3 62.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.458 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -58.25 8.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.532 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -29.03 30.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.399 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 28.4 tttm -70.04 -26.25 63.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.2 mt -76.76 -32.34 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 0.0 110.712 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -69.0 -32.57 72.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.443 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.479 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.32 -29.97 60.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.518 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.73 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.2 mt -55.45 160.82 2.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.963 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.51 -101.03 2.57 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.511 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 50' ' ' VAL . . . -128.15 -47.22 0.18 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.63 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -144.88 176.44 23.95 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.498 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.37 -81.4 1.38 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.505 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.14 -16.83 61.44 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.632 0.253 . . . . 0.0 111.3 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.463 HG21 ' O ' ' A' ' 46' ' ' GLY . 22.1 t -56.0 -21.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.609 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -75.61 -25.95 57.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -78.01 -57.31 3.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.108 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.73 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.8 t -57.45 -29.8 34.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.369 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -38.57 90.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 110.649 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.69 -27.68 63.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.862 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.59 -29.28 66.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.307 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.139 HG22 HD21 ' A' ' 37' ' ' LEU . 15.4 t -83.21 -25.77 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.919 0.39 . . . . 0.0 111.187 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.84 -28.31 60.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.275 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmt? -75.16 -41.01 59.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.76 -179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.925 ' HG ' HD23 ' A' ' 30' ' ' LEU . 2.1 tt -73.59 -27.64 61.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.642 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.58 -56.04 11.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.885 0.374 . . . . 0.0 110.789 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 65' ' ' LYS . 6.3 tt0 -61.11 -26.93 68.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.985 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.91 -49.38 75.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.389 -179.485 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.581 ' CG1' HD22 ' A' ' 30' ' ' LEU . 16.8 mt -63.82 -24.46 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.755 0.312 . . . . 0.0 111.313 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 49.7 mmtt -55.99 -37.66 69.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.131 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.78 -54.24 24.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.699 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' OXT' ' A' ' 67' ' ' LEU . 1.8 pp . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.076 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.618 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.179 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.4 m -68.48 132.51 47.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.865 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.1 ttm-85 -122.71 -55.82 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.98 -29.82 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.264 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.69 -35.05 70.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.77 39.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.187 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -64.97 -28.49 69.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.007 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -73.33 -33.35 65.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.078 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -77.2 -20.01 55.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.302 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -45.63 65.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.255 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.489 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.9 t -75.91 -29.42 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.475 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -35.86 81.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.979 0.419 . . . . 0.0 110.173 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -24.06 37.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.515 0.674 . . . . 0.0 109.467 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.613 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER -66.05 -25.15 66.92 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.915 179.426 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.85 -56.13 4.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.365 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -47.04 -29.52 2.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.366 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -76.04 -39.53 55.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.003 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.659 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 25.0 t -78.09 -51.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.326 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -51.21 -29.87 15.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.408 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.93 -11.78 35.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.327 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.581 HD11 HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -68.37 -69.75 0.31 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.868 0.366 . . . . 0.0 110.937 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 160.63 -120.71 0.97 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.445 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 172.32 157.59 14.53 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.579 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 97.52 95.19 1.92 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.504 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 115.31 -136.68 13.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.508 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.924 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -56.88 -27.77 60.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 111.02 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -70.14 -29.66 40.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.282 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -56.09 22.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.75 68.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.91 HD23 ' HG ' ' A' ' 60' ' ' LEU . 9.3 mt -71.16 -21.62 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.612 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -78.53 -58.97 2.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.08 -59.04 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.641 ' NZ ' HD12 ' A' ' 60' ' ' LEU . 4.1 ttpm? -61.22 -25.06 66.8 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.936 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.21 -57.63 11.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.842 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.34 -55.41 16.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.511 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 33.7 tt0 -48.47 -28.51 3.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.983 0.421 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.1 HD21 HG22 ' A' ' 57' ' ' VAL . 10.9 tp -70.32 -42.63 71.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.805 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -58.49 6.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 111.739 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.23 -27.94 10.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.513 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.43 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 7.9 ttpt -70.73 -28.22 64.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.093 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.14 -32.76 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.659 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.09 -33.38 74.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.344 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.4 pt-20 -73.98 -29.73 62.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 HG22 ' A' ' 50' ' ' VAL . 9.8 mt -62.25 162.69 9.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -128.31 -88.35 0.58 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.505 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -88.32 -100.84 0.94 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.519 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.34 -141.46 4.8 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.498 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.92 -81.32 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.489 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.425 ' CD ' HD21 ' A' ' 44' ' ' LEU . 3.4 tt0 -68.53 -26.12 65.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.779 0.324 . . . . 0.0 111.002 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.6 HG22 HD13 ' A' ' 44' ' ' LEU . 21.7 t -59.28 -19.66 16.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.519 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -70.65 -35.06 72.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -73.56 -57.15 4.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.545 ' O ' HG23 ' A' ' 57' ' ' VAL . 38.7 t -53.14 -25.96 10.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.309 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -35.83 82.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.609 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -74.54 -27.88 60.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.73 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -70.12 -28.73 65.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.1 HG22 HD21 ' A' ' 37' ' ' LEU . 15.9 t -83.1 -25.83 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -75.27 -28.42 59.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.533 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -76.06 -38.56 56.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.91 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.18 -25.09 47.0 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.598 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -54.18 15.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.001 0.429 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -64.76 -26.83 68.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.651 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.903 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -58.78 -56.2 25.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.9 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.699 ' CG1' HD22 ' A' ' 30' ' ' LEU . 23.5 mt -59.15 -24.5 27.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.187 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -31.54 72.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.88 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 mttm -64.62 -46.14 83.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.924 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.901 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.659 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.584 -0.206 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.14 44.17 10.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.357 . . . . 0.0 110.821 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -101.68 -54.13 2.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.9 p -65.34 -29.2 46.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.178 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -57.43 -35.66 70.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.831 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.72 -25.87 54.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.157 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.495 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -63.85 -27.07 68.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.993 179.991 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HG3' HG21 ' A' ' 41' ' ' ILE . 53.2 mt-10 -75.12 -32.54 61.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.243 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -77.19 -20.68 55.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.245 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -68.86 -51.0 45.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.016 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.682 HG22 ' CG1' ' A' ' 57' ' ' VAL . 14.7 t -71.57 -29.14 33.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.492 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.9 ttpt -60.86 -36.38 79.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.441 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.1 -24.67 37.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.409 0.623 . . . . 0.0 109.559 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.49 -25.4 67.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.892 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.7 tt0 -77.71 -47.76 18.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.25 -29.57 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.319 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -76.14 -40.01 53.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.676 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 10.1 t -78.01 -59.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.997 0.427 . . . . 0.0 111.235 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -51.49 -22.82 3.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.99 -18.28 29.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.379 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.834 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp -99.88 173.0 6.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.771 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -144.66 150.42 22.55 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.517 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 150.89 -169.09 30.66 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.54 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -143.54 168.19 26.36 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.516 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.81 -98.42 2.28 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.569 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -54.67 -62.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.111 0.481 . . . . 0.0 110.842 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.834 HG21 HD11 ' A' ' 21' ' ' LEU . 4.9 mt -55.42 -29.55 24.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.803 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -56.24 20.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.666 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.16 -41.12 87.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.991 0.424 . . . . 0.0 110.853 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.932 HD23 ' HG ' ' A' ' 60' ' ' LEU . 2.9 mt -59.41 -21.13 59.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.702 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.4 -59.0 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -59.05 4.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.886 0.374 . . . . 0.0 111.691 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HZ3' HD12 ' A' ' 60' ' ' LEU . 1.3 ttpt -61.21 -24.86 66.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.845 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.38 -57.5 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.908 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.34 -54.63 16.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -178.471 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.52 -28.3 3.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.02 0.438 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.041 HD21 HG22 ' A' ' 57' ' ' VAL . 9.0 tp -69.13 -41.48 77.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.468 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -58.26 8.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.44 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -52.02 -27.93 15.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.409 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.25 -29.07 67.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.047 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.402 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.7 mt -75.2 -32.59 26.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 0.0 110.602 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -31.3 71.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.394 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.1 OUTLIER -76.37 -29.93 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.473 179.673 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.652 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.4 mt -61.6 159.69 12.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.976 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -142.27 37.05 1.6 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.489 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.568 ' HA2' HG21 ' A' ' 50' ' ' VAL . . . 67.79 149.93 0.2 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.72 -142.52 13.85 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.476 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -95.29 -36.72 5.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.47 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.14 -27.11 65.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 111.043 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.617 HG22 HD22 ' A' ' 44' ' ' LEU . 21.8 t -56.01 -26.3 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -62.93 -32.15 73.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.054 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.17 -57.19 13.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.85 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.652 ' CG2' HD11 ' A' ' 44' ' ' LEU . 22.9 t -57.46 -25.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.209 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.17 -32.92 74.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -27.85 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -70.08 -28.72 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.041 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.22 -25.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.062 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -28.63 59.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.587 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.24 -37.77 57.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.142 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.932 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.4 tt -78.04 -25.24 47.71 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.581 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -55.44 10.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.051 0.453 . . . . 0.0 110.268 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -63.56 -26.88 68.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.813 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.93 ' HB3' HD21 ' A' ' 30' ' ' LEU . 11.9 mm-40 -60.11 -50.99 71.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.976 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.901 ' CG1' HD22 ' A' ' 30' ' ' LEU . 22.1 mt -61.74 -24.18 33.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.17 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -30.66 71.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.023 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -65.9 -61.43 2.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.564 HD11 HG23 ' A' ' 64' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.989 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.676 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.395 -0.282 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t -116.96 159.98 21.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.84 0.352 . . . . 0.0 110.858 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.85 -55.13 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.883 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.19 -40.87 80.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.997 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.52 -31.98 64.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.804 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -80.84 -25.89 37.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.086 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.52 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER -66.74 -28.31 68.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.224 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.56 -31.21 53.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.549 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 4.4 pt-20 -77.15 -22.4 52.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.714 0.292 . . . . 0.0 111.254 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -54.36 8.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 HG13 ' A' ' 57' ' ' VAL . 25.1 t -65.79 -29.41 46.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.492 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -59.03 -36.78 75.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.68 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.28 -23.97 40.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.488 0.661 . . . . 0.0 109.336 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.07 -25.25 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.82 179.316 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 54.4 tt0 -78.34 -41.98 31.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.212 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -55.14 -30.98 60.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.031 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.469 ' HD3' HG21 ' A' ' 64' ' ' ILE . 10.8 tttm -76.08 -42.84 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.25 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' LEU . 2.9 t -73.43 -52.55 21.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.475 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.6 mttt -50.01 -31.07 11.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.22 -10.89 36.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.36 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -72.33 -69.73 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.936 -179.867 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 160.43 -122.68 1.14 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.489 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.79 128.35 0.98 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.526 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.02 90.61 0.27 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.515 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.37 -117.47 4.88 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.509 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.556 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.95 -44.01 86.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.995 -179.943 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.506 HG12 HD13 ' A' ' 21' ' ' LEU . 7.5 mt -64.94 -29.57 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.58 -56.35 23.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.708 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.68 -47.02 85.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.933 0.397 . . . . 0.0 111.182 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.889 HD13 HG12 ' A' ' 64' ' ' ILE . 76.4 mt -57.87 -21.06 41.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.86 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -74.51 -59.1 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -50.9 -46.81 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.76 -24.66 60.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.095 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.07 -57.78 9.5 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.585 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -70.29 -52.45 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.767 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.484 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.2 tm-20 -50.18 -28.2 7.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.159 0.504 . . . . 0.0 110.937 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.048 HD21 HG22 ' A' ' 57' ' ' VAL . 8.5 tp -69.86 -43.68 71.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.224 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.81 -58.29 9.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.314 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -52.62 -27.9 19.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.331 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 -25.78 63.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.216 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.2 mt -79.35 -32.81 15.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 111.042 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -66.65 -38.73 87.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.738 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -70.33 -37.54 74.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.826 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.2 mt -53.55 166.91 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.049 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -128.14 -84.18 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.503 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -168.31 106.17 0.25 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.544 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.432 ' H ' HG11 ' A' ' 50' ' ' VAL . . . 82.78 147.1 6.64 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.524 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.2 -87.23 0.61 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.04 -19.81 19.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.728 0.299 . . . . 0.0 111.058 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.432 HG11 ' H ' ' A' ' 47' ' ' GLY . 14.7 p -49.06 -29.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.519 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -71.98 -29.44 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -69.12 -57.34 5.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.069 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.826 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.6 t -56.85 -29.55 30.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.08 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -61.38 -40.41 94.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.49 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.93 -27.82 65.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.682 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -68.52 -28.66 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.006 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.048 HG22 HD21 ' A' ' 37' ' ' LEU . 18.5 t -82.76 -25.86 8.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.078 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt -75.12 -28.18 60.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.513 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -75.65 -38.39 58.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.672 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.22 -25.77 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.401 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -70.98 -51.35 26.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.017 0.437 . . . . 0.0 110.738 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -67.64 -26.65 66.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.217 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.723 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.74 -59.06 5.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.434 -179.422 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.889 HG12 HD13 ' A' ' 30' ' ' LEU . 35.3 mt -50.31 -28.39 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.536 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -27.48 65.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.733 0.301 . . . . 0.0 110.895 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.33 -55.26 5.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.672 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.875 HD21 HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.879 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.646 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.146 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.9 p -129.06 135.0 48.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.05 -50.74 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.846 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.852 HG22 HG11 ' A' ' 50' ' ' VAL . 15.4 t -82.95 -40.35 16.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -57.1 -32.0 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.53 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -77.22 -25.7 51.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.122 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.514 HD11 ' HA ' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -66.09 -39.54 90.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.325 -179.622 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HG3' HG21 ' A' ' 41' ' ' ILE . 62.6 mt-10 -67.62 -32.93 73.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.53 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 3.6 pt-20 -77.27 -20.1 55.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.734 0.302 . . . . 0.0 111.312 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -43.56 58.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.58 HG22 HG13 ' A' ' 57' ' ' VAL . 23.2 t -75.41 -29.3 21.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.475 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -62.75 -35.83 81.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 0.0 110.182 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 -23.86 37.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.549 0.69 . . . . 0.0 109.499 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.516 HD21 HD23 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -66.38 -25.49 66.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.875 179.439 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 25.1 tt0 -74.93 -51.54 13.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.207 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -51.3 -27.33 9.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.128 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -76.05 -40.94 52.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.832 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.662 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 19.1 t -78.08 -52.6 15.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.068 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.4 mtpp -55.55 -19.92 11.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.33 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.75 -17.57 26.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.43 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.551 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.5 pp -99.95 157.74 16.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.86 0.362 . . . . 0.0 110.808 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.463 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -132.78 161.27 24.04 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.643 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 149.85 -168.32 29.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.436 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.6 135.43 5.94 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.537 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 123.92 -111.1 1.56 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.55 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.899 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.99 -27.62 61.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.745 0.307 . . . . 0.0 111.063 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.422 HD13 ' CD1' ' A' ' 21' ' ' LEU . 58.8 mt -66.04 -29.73 47.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.464 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.21 -56.14 12.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.484 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -59.16 -26.87 65.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.78 0.324 . . . . 0.0 111.369 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.646 HD11 ' OE1' ' A' ' 63' ' ' GLU . 92.1 mt -79.56 -21.61 44.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.72 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -76.74 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.67 -51.55 55.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 111.742 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -66.74 -25.12 66.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.844 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.09 -57.62 11.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.989 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.06 -55.3 14.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 112.057 -178.672 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.23 -28.44 3.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.061 0.458 . . . . 0.0 111.336 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.078 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.07 -41.7 77.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.486 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -58.17 8.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.628 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 2.9 ptmt -52.1 -27.96 15.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.47 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 22.1 tttt -70.58 -25.56 63.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.502 HG21 ' HG3' ' A' ' 8' ' ' GLU . 6.9 mt -77.11 -40.79 30.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 111.089 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 1.9 pt-20 -65.89 -28.89 69.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.812 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 5.5 pt-20 -77.68 -30.92 52.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.375 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.64 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.0 mt -57.94 -176.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.935 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -151.87 -103.35 0.25 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.52 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -151.49 113.87 0.61 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.499 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 173.29 -144.72 7.92 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.561 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -94.96 12.28 68.66 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.797 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.408 ' HG2' HD21 ' A' ' 44' ' ' LEU . 11.8 tt0 -95.08 -24.87 16.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.778 0.323 . . . . 0.0 110.963 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.852 HG11 HG22 ' A' ' 4' ' ' VAL . 31.6 t -56.11 -22.79 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.41 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.95 -29.89 55.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.897 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.03 -57.27 6.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.95 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.64 ' CG2' HD11 ' A' ' 44' ' ' LEU . 23.8 t -60.19 -29.87 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' HD11 ' A' ' 7' ' ' LEU . 7.2 tp10 -62.51 -33.27 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.645 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -27.89 53.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.794 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -67.9 -29.21 68.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.078 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.26 -25.61 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.032 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -73.44 -28.15 61.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.35 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.585 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -74.07 -24.98 59.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.054 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -56.0 8.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.937 0.399 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -61.35 -26.99 68.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.153 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.646 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.3 tm-20 -61.99 -58.93 6.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.103 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.551 HG12 HD13 ' A' ' 30' ' ' LEU . 31.5 mt -52.89 -25.2 8.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.269 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -67.91 -44.93 75.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.899 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.95 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.662 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 91.9 p -137.03 127.59 26.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.908 0.385 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 -138.14 -64.09 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.903 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.92 -43.7 20.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.129 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -31.66 61.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.806 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 -25.52 53.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.028 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -67.57 -35.42 78.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.35 -179.663 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HG3' HG21 ' A' ' 41' ' ' ILE . 39.2 mt-10 -74.39 -35.8 63.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.694 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.61 -19.7 60.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.704 0.288 . . . . 0.0 111.523 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -73.07 -51.04 19.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.202 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.608 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.5 t -68.4 -29.21 43.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.648 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -36.71 77.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.99 -23.92 38.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.532 0.682 . . . . 0.0 109.508 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.587 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.31 -25.14 67.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.834 179.271 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 26.0 tt0 -75.1 -44.95 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.54 -26.12 12.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.99 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -76.08 -54.45 6.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.643 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.4 t -65.0 -53.45 41.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.261 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 3.1 mtpp -53.58 -26.55 22.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.22 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.69 -10.91 38.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.46 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.448 HD22 ' H ' ' A' ' 22' ' ' GLY . 0.6 OUTLIER -78.63 -157.55 0.12 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.626 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.448 ' H ' HD22 ' A' ' 21' ' ' LEU . . . 164.39 107.86 0.21 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.482 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -156.48 -122.78 0.76 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.484 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 175.06 92.68 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.473 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.4 -99.96 0.21 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.478 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.88 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -57.04 -27.66 61.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.739 0.304 . . . . 0.0 111.07 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.5 mt -73.94 -29.61 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.293 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -65.05 -56.14 14.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.599 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.46 -35.14 76.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 0.0 111.202 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.751 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.0 mt -69.97 -21.42 63.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.659 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -76.64 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.628 0.251 . . . . 0.0 111.577 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.34 -37.08 62.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.581 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.446 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.48 -24.84 45.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.746 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -57.95 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -40.5 90.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.079 -178.491 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.12 -28.21 69.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 111.081 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.935 HD11 HG22 ' A' ' 57' ' ' VAL . 0.1 OUTLIER -70.18 -55.1 10.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.673 -179.107 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.96 -58.11 6.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 111.596 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.0 -27.92 8.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.413 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HE3' HG22 ' A' ' 53' ' ' VAL . 7.0 ttpt -71.09 -28.46 64.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.999 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.495 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.9 mt -75.07 -31.35 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.636 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.92 -34.45 75.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -72.59 -29.76 63.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.461 179.559 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.635 HD13 HG23 ' A' ' 50' ' ' VAL . 5.6 mt -57.46 -175.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.945 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -151.4 -81.09 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -175.5 37.89 0.1 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.478 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.48 -160.94 26.06 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.555 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -87.57 8.37 77.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.851 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.15 -23.2 17.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.832 0.348 . . . . 0.0 110.979 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.635 HG23 HD13 ' A' ' 44' ' ' LEU . 13.6 p -52.55 -30.65 14.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.33 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -60.57 -27.14 67.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.139 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -68.52 -57.25 6.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.063 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.626 ' O ' HG23 ' A' ' 57' ' ' VAL . 23.9 t -53.68 -26.08 12.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.222 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' HD11 ' A' ' 7' ' ' LEU . 6.7 mt-10 -65.2 -32.6 74.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.482 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.56 -27.94 51.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.705 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -68.62 -28.85 67.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.574 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.935 HG22 HD11 ' A' ' 37' ' ' LEU . 2.5 t -83.09 -25.52 8.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.894 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -28.18 61.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.527 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -75.27 -43.32 51.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.751 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.91 -25.15 58.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.999 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -54.1 12.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -62.87 -27.02 69.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.108 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.621 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.7 -59.0 5.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.479 HG12 HD13 ' A' ' 30' ' ' LEU . 29.9 mt -55.16 -26.15 17.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -61.72 -34.23 75.42 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.879 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -64.26 -56.04 17.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.8 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.88 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.643 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.3 m -146.25 177.22 9.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.9 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.03 -66.89 0.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.6 t -72.82 -42.65 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -55.87 -31.84 63.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.757 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.75 -25.56 41.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.993 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.58 -28.96 68.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.272 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.467 ' HG2' HG21 ' A' ' 41' ' ' ILE . 29.7 mt-10 -79.01 -39.71 33.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -19.75 62.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.4 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -53.9 15.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.42 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.605 HG22 HG13 ' A' ' 57' ' ' VAL . 19.6 t -66.54 -29.3 46.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.754 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -59.48 -36.71 76.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.628 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.42 -23.83 40.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.576 0.703 . . . . 0.0 109.393 178.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.41 -25.26 67.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.912 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 42.0 tt0 -77.33 -52.89 8.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.241 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -49.99 -27.95 6.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.894 0.378 . . . . 0.0 111.197 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -76.09 -42.74 46.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.661 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 14.8 t -76.41 -48.44 27.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.2 OUTLIER -50.02 -32.38 15.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.273 -179.58 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.1 -10.82 40.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.45 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.72 HD23 ' H ' ' A' ' 22' ' ' GLY . 0.3 OUTLIER -63.57 165.25 8.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.895 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.72 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -70.7 -123.03 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.42 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.5 124.59 1.12 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.469 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' HD12 ' A' ' 27' ' ' ILE . . . -157.57 -110.68 0.3 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -120.88 -56.91 0.23 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.621 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.78 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.43 -27.72 62.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.76 0.314 . . . . 0.0 111.01 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 24' ' ' GLY . 59.2 mt -67.65 -29.72 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.368 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.45 -56.18 12.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.659 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.63 -27.56 66.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.297 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.585 ' O ' HD11 ' A' ' 60' ' ' LEU . 84.5 mt -78.87 -21.58 47.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.749 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.0 -58.66 3.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.715 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.35 -43.28 61.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.758 0.313 . . . . 0.0 111.824 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.86 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.015 -179.239 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.25 -57.78 9.32 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.733 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -46.54 68.72 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.22 -28.07 38.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.075 0.464 . . . . 0.0 110.855 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.98 HD21 HG22 ' A' ' 57' ' ' VAL . 7.8 tp -70.88 -42.74 69.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.529 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.3 9.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.797 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -51.34 -27.76 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.661 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -25.97 60.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.296 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.467 HG21 ' HG2' ' A' ' 8' ' ' GLU . 10.0 mt -71.26 -57.03 8.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.8 0.333 . . . . 0.0 110.681 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -23.93 64.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.128 0.49 . . . . 0.0 110.038 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -86.33 -12.98 47.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.206 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.527 HD11 ' CG2' ' A' ' 53' ' ' VAL . 2.2 mt -71.32 164.22 26.15 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.914 0.388 . . . . 0.0 110.902 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.97 -103.39 2.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.514 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -159.74 126.95 1.72 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.604 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 62.71 144.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.622 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.99 -88.91 1.43 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.654 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.442 ' HG2' HD21 ' A' ' 44' ' ' LEU . 22.2 tt0 -57.26 -27.7 62.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.761 0.315 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.462 ' HA ' HD13 ' A' ' 44' ' ' LEU . 27.1 t -55.34 -24.65 15.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -28.77 58.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.932 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -57.41 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.87 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 57' ' ' VAL . 24.7 t -62.59 -26.02 39.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -67.09 -34.66 78.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.615 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.56 -27.96 58.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.798 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.57 -28.94 65.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.009 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.98 HG22 HD21 ' A' ' 37' ' ' LEU . 21.3 t -83.13 -25.84 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.168 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -28.48 59.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.655 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.31 -42.01 46.67 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.646 HD23 HD21 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -75.48 -25.0 57.0 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.261 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.06 -55.35 9.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.984 0.421 . . . . 0.0 110.552 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.64 -27.0 68.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.242 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.21 -59.11 5.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.283 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.623 HD13 HG22 ' A' ' 18' ' ' VAL . 30.3 mt -54.42 -26.41 15.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.211 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -33.35 75.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.1 mmtt -68.06 -58.99 3.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.78 HD22 ' CG ' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.956 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.661 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.35 -176.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 0.0 110.913 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 ttt85 -133.95 -63.04 0.75 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -74.15 -35.44 40.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.079 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.68 -28.07 66.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.02 -25.26 40.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.111 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 -32.22 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.358 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -83.09 -35.55 25.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.355 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -73.13 -19.72 61.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -55.05 8.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.991 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.507 HG22 HG13 ' A' ' 57' ' ' VAL . 21.3 t -63.89 -29.37 47.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.277 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -36.97 75.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -23.98 41.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.461 0.648 . . . . 0.0 109.635 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.39 -25.45 67.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.721 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.426 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 36.3 tt0 -77.0 -40.57 46.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.246 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -54.29 -27.94 38.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 64' ' ' ILE . 2.9 ttpm? -76.21 -47.67 23.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.677 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.6 t -70.55 -53.31 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.445 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.0 mttt -50.05 -30.82 11.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.478 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.21 -10.99 60.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.541 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.821 HD13 ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.82 167.56 4.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.456 -179.714 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.559 ' N ' HD22 ' A' ' 21' ' ' LEU . . . -154.58 22.5 0.63 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.605 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.63 -121.87 2.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.518 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.01 173.33 46.19 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.91 -114.24 4.59 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.475 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.651 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -52.8 -43.53 65.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.048 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.786 HG21 ' HG ' ' A' ' 21' ' ' LEU . 3.6 mt -59.7 -29.41 42.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.754 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -56.27 24.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -58.25 -38.59 77.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.453 . . . . 0.0 111.187 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.788 HD13 HG12 ' A' ' 64' ' ' ILE . 16.2 mt -66.15 -21.09 66.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.657 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -75.45 -55.93 5.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -53.83 -51.45 63.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.735 0.302 . . . . 0.0 111.606 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -68.15 -25.05 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.931 -179.251 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.86 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.04 -54.27 19.61 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.2 tt0 -48.53 -28.37 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.062 0.458 . . . . 0.0 111.19 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.013 HD21 HG22 ' A' ' 57' ' ' VAL . 3.2 tp -68.87 -41.14 78.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.259 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -61.7 -58.27 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.15 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -27.98 25.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 27.3 tttt -68.9 -27.43 65.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.967 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 HG11 ' A' ' 53' ' ' VAL . 8.9 mt -73.88 -31.06 29.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.903 0.382 . . . . 0.0 110.653 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -69.56 -34.6 74.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.423 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -72.53 -29.1 63.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.6 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.4 mt -58.34 169.33 0.89 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.994 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -132.99 -117.39 1.82 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -73.27 -138.79 0.36 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.511 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -91.74 177.25 40.22 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.613 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.8 -79.36 0.8 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.496 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG2' HD21 ' A' ' 44' ' ' LEU . 27.1 tt0 -63.08 -18.0 62.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 111.191 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.22 -16.92 17.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.565 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.19 -33.21 65.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.796 0.332 . . . . 0.0 111.098 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -65.99 -57.28 8.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.539 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.5 t -59.89 -25.73 33.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.216 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.32 -37.28 85.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.72 -27.74 62.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -70.67 -29.7 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.031 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.013 HG22 HD21 ' A' ' 37' ' ' LEU . 19.8 t -83.33 -25.87 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.204 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -75.34 -28.42 59.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.667 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -41.28 57.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.16 -26.16 47.61 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -178.952 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.487 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.53 -49.38 48.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.088 0.47 . . . . 0.0 110.728 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.11 -26.82 65.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.4 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.623 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -63.41 -59.1 5.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.29 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.788 HG12 HD13 ' A' ' 30' ' ' LEU . 39.6 mt -50.58 -28.41 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.387 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -64.43 -31.49 72.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -71.61 -55.83 7.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.628 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.651 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.866 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.62 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.141 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.1 p -152.05 31.18 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.744 0.307 . . . . 0.0 110.871 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -139.34 -75.4 0.36 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.896 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.1 t -66.67 -30.76 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -57.88 -30.73 66.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.65 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 9' ' ' GLU . . . -77.67 -25.36 49.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.085 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -31.49 69.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.301 -179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -82.24 -37.99 25.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.58 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -71.05 -19.87 62.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.782 0.325 . . . . 0.0 111.147 -179.831 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -52.84 10.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.896 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.422 HG22 HG13 ' A' ' 57' ' ' VAL . 18.1 t -61.71 -29.19 45.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.426 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -37.26 73.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.774 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 -24.34 40.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.477 0.656 . . . . 0.0 109.611 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.685 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.2 tt -65.36 -25.18 67.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.761 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 56.8 tt0 -79.09 -42.72 25.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.353 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -53.7 -27.54 28.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.105 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 tppt? -76.16 -48.36 20.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.249 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.657 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.2 t -70.78 -49.6 49.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.618 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 10.2 mttt -51.24 -31.73 21.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.798 0.333 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.32 -10.85 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.419 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.785 HD11 HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -77.67 165.29 24.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.664 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.503 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -67.86 -81.01 0.19 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.315 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 129.78 128.85 3.06 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.561 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.5 88.39 0.23 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.525 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 115.61 -117.34 3.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.583 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.519 ' HG2' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.34 -27.54 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.798 0.333 . . . . 0.0 111.023 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.613 HG12 HD13 ' A' ' 21' ' ' LEU . 22.3 mt -73.55 -29.61 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.467 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -56.18 18.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.684 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.91 -42.82 94.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.392 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.58 HD13 HG12 ' A' ' 64' ' ' ILE . 53.7 mt -63.63 -21.41 66.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.811 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -75.81 -59.08 2.91 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.2 tttp -50.59 -56.32 12.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.768 0.318 . . . . 0.0 111.753 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.74 -24.99 67.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.767 -179.422 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.04 -57.88 10.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.518 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.14 -56.44 9.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.072 -178.498 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.518 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -47.94 -28.36 2.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.388 . . . . 0.0 111.412 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.059 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -67.54 -39.88 85.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.344 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -58.2 5.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.469 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -52.89 -27.68 19.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.341 -179.743 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.409 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 10.6 tttt -68.5 -28.73 67.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 mt -73.63 -31.0 30.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.657 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.19 -33.93 74.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.466 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -73.24 -29.2 62.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.62 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.7 mt -59.11 163.44 3.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.901 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.83 -44.71 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.483 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 139.77 127.46 2.41 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.603 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 166.13 -34.22 0.23 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.58 -28.47 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.472 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.487 ' HB3' HD21 ' A' ' 44' ' ' LEU . 0.8 OUTLIER -58.96 -21.31 58.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.706 0.289 . . . . 0.0 111.118 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -53.37 -24.69 9.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.439 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -72.43 -36.5 68.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.89 0.376 . . . . 0.0 110.973 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -62.96 -57.23 11.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.3 t -57.93 -28.05 32.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.372 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.46 -36.24 83.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 110.728 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.34 -27.73 60.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.969 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.27 -29.26 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.377 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.059 HG22 HD21 ' A' ' 37' ' ' LEU . 17.5 t -83.27 -26.67 7.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.347 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.47 -28.38 59.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.691 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -76.79 -40.77 47.02 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.51 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.08 -25.81 47.84 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.978 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 -52.41 17.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.878 0.371 . . . . 0.0 110.55 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.46 -26.97 68.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.085 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.48 -59.13 5.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.835 HG23 HD11 ' A' ' 67' ' ' LEU . 35.2 mt -55.01 -25.69 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.254 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.02 -31.85 61.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.369 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -105.08 -69.35 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.236 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.835 HD11 HG23 ' A' ' 64' ' ' ILE . 87.5 mt . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.657 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.576 -0.209 . . . . 0.0 112.576 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -110.73 133.13 53.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.902 0.382 . . . . 0.0 110.909 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.96 -48.54 2.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 p -82.95 -33.44 10.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.125 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -58.29 -33.86 69.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.836 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.49 -25.88 35.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.07 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.421 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -65.6 -28.03 68.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.065 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' CG2' ' A' ' 41' ' ' ILE . 53.7 mt-10 -75.5 -37.0 60.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -19.95 60.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.432 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.22 -48.81 40.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.006 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.444 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.6 t -68.64 -29.3 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.514 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.0 -36.52 77.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.458 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -23.86 40.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.639 0.733 . . . . 0.0 109.407 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.749 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.4 OUTLIER -65.71 -25.22 67.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.982 179.38 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -75.87 -55.33 5.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.398 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -47.14 -30.91 3.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -37.94 57.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.769 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.749 HG23 ' O ' ' A' ' 14' ' ' LEU . 21.4 t -78.15 -48.66 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.303 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -31.55 17.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.335 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.16 -10.98 39.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.542 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.689 HD11 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -66.45 -69.0 0.33 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.841 0.353 . . . . 0.0 110.909 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.03 -117.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.528 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 164.13 126.58 0.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.508 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 149.65 84.83 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.55 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.0 -118.15 4.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.768 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.03 -27.81 69.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.023 -179.932 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.455 ' CD1' HD22 ' A' ' 21' ' ' LEU . 25.6 mt -65.42 -29.76 48.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.501 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -64.66 -56.25 15.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.661 -179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.06 -26.89 66.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.727 0.298 . . . . 0.0 111.226 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 87.9 mt -77.21 -21.77 53.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.517 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -59.44 2.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.688 0.28 . . . . 0.0 111.724 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.03 -37.82 61.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.786 0.327 . . . . 0.0 111.722 -179.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.77 -24.87 41.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.831 -179.409 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.7 -57.96 8.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.794 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.04 74.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.552 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -27.98 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.189 0.519 . . . . 0.0 110.561 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.115 HD21 HG22 ' A' ' 57' ' ' VAL . 12.5 tp -76.55 -38.9 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.536 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -28.48 69.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.107 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -79.05 -27.63 43.13 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -73.13 -34.18 65.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.49 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.41 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 12.3 mt -67.37 -57.7 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.721 0.296 . . . . 0.0 110.701 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -58.28 -23.97 57.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.195 0.521 . . . . 0.0 110.044 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -84.81 -12.88 52.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.162 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.2 mt -77.58 162.49 27.04 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.939 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -117.04 -63.06 0.32 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.406 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.512 ' HA2' HG21 ' A' ' 50' ' ' VAL . . . 148.69 137.6 2.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.519 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.69 -99.31 0.19 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.525 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -122.26 -38.38 0.6 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.457 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.8 -25.07 60.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.748 0.309 . . . . 0.0 111.115 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.512 HG21 ' HA2' ' A' ' 46' ' ' GLY . 21.9 t -56.69 -22.19 14.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.417 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -72.99 -29.73 63.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.1 -57.29 6.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.867 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.1 t -57.91 -28.1 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 -37.78 88.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.81 -27.99 63.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.728 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.57 -30.28 69.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.115 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.03 -25.55 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.164 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.7 -27.92 61.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.458 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' CE ' ' HG3' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -75.24 -40.94 58.52 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.581 HD23 HD21 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -76.89 -25.09 52.63 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.032 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -53.74 14.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.639 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -64.75 -26.89 68.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.524 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.26 -59.09 5.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.699 HD13 HG22 ' A' ' 18' ' ' VAL . 28.1 mt -56.42 -25.41 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.231 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.36 75.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.922 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 39.9 mtpt -71.25 -57.75 4.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.738 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.768 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.896 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.641 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 p -64.66 155.45 33.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.78 -67.08 0.16 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.899 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -82.94 -37.76 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.205 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -32.85 67.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.674 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.66 -25.5 53.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.032 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.497 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -69.61 -30.47 68.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.334 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.416 ' HG2' HG21 ' A' ' 41' ' ' ILE . 30.7 mt-10 -80.27 -37.69 32.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.504 -179.439 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -19.74 61.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.348 -179.799 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -48.96 25.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.447 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.635 HG22 HG13 ' A' ' 57' ' ' VAL . 17.8 t -68.21 -29.2 43.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.709 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -36.49 77.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.606 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.05 -24.0 38.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.445 0.64 . . . . 0.0 109.768 178.773 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.704 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.5 tt -66.37 -25.08 66.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.753 179.497 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.417 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 27.6 tt0 -77.27 -46.46 23.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -179.626 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -49.6 -27.86 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -76.21 -48.69 19.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.388 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.622 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.7 t -70.0 -51.46 39.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.7 mttt -51.0 -31.17 17.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.798 0.333 . . . . 0.0 111.129 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.62 -10.91 47.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.472 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.842 HD22 HD13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER -71.73 165.48 23.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 -179.986 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.666 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -154.35 93.88 0.14 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.516 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.405 ' CA ' HD12 ' A' ' 27' ' ' ILE . . . -172.97 -139.01 2.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.588 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -164.36 -173.61 33.21 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.472 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.64 -110.62 3.13 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.509 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.871 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.8 -27.74 63.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.725 0.298 . . . . 0.0 110.955 179.899 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.842 HD13 HD22 ' A' ' 21' ' ' LEU . 29.4 mt -67.63 -29.79 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.711 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -43.65 71.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.93 -179.179 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -70.14 -26.85 64.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.685 0.279 . . . . 0.0 111.432 -179.419 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 72.8 mt -81.06 -21.62 39.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.494 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.74 -59.15 2.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.343 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -52.64 -48.23 66.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.64 -179.539 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.22 -25.2 65.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.736 -179.484 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.25 -57.87 9.83 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.001 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.87 -55.06 18.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.904 -178.596 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.7 tt0 -49.33 -28.47 4.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 5.0 tp -67.96 -38.56 82.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.281 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -66.48 -58.36 5.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.259 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.439 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 3.1 pttt -51.61 -27.51 11.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.202 -179.871 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.484 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 2.7 tptm -70.8 -25.81 63.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.0 mt -75.71 -42.1 40.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.08 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.26 -30.72 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.608 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 2.9 pt-20 -75.62 -30.66 59.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.095 0.474 . . . . 0.0 110.513 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.3 mt -56.86 162.4 2.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.791 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.96 -96.58 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.662 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -161.94 57.27 0.3 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -113.81 -27.46 3.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.542 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.79 -16.39 4.0 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.692 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.606 ' HB3' HD21 ' A' ' 44' ' ' LEU . 11.7 tt0 -62.14 -17.28 57.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 111.334 -179.883 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.3 t -52.5 -25.11 7.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.302 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.55 -28.6 65.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -73.29 -57.18 4.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.4 t -55.51 -26.3 19.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.479 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -65.41 -38.05 88.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.99 0.424 . . . . 0.0 110.591 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -72.32 -27.61 62.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.893 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -71.41 -28.9 64.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.493 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.32 -27.7 7.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.283 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -75.61 -28.42 58.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.653 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -76.29 -40.18 52.33 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -178.81 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.07 -26.16 48.05 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -71.05 -49.47 44.4 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.934 0.397 . . . . 0.0 110.637 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.72 -26.9 65.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.238 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.506 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -62.36 -59.26 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.095 -179.631 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.58 HG12 HD13 ' A' ' 30' ' ' LEU . 39.1 mt -51.31 -25.86 4.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -33.99 75.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -43.82 79.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.818 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.871 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.015 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.622 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.94 -175.77 2.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.809 0.337 . . . . 0.0 110.827 -179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 19.8 ttm-85 -84.14 -31.78 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.674 HG22 ' CG2' ' A' ' 50' ' ' VAL . 18.1 t -66.77 -28.09 42.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.194 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -37.3 66.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -73.67 -25.85 60.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.059 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.401 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER -66.15 -29.31 69.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.195 -179.804 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.511 ' HG3' HG21 ' A' ' 41' ' ' ILE . 45.9 mt-10 -76.76 -31.38 57.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.601 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 5.8 pt-20 -77.05 -22.34 53.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.731 0.3 . . . . 0.0 111.307 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.28 -55.04 8.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.01 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.587 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -65.4 -29.38 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.508 -179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.45 -37.18 74.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.718 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.05 -24.26 40.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.613 0.72 . . . . 0.0 109.468 178.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -64.52 -25.2 67.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.815 179.237 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.418 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 47.6 tt0 -77.56 -43.89 30.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.277 -179.417 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -52.94 -29.69 30.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.188 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -76.03 -50.57 14.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.346 -179.786 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.692 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 28.3 t -66.19 -53.1 40.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.509 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.418 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.5 mttt -50.52 -30.51 13.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.353 -179.497 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.06 -11.06 36.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.435 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.778 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER -68.99 -70.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.106 -179.86 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.56 163.06 38.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.508 -179.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.29 -163.43 15.75 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.525 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.71 -179.75 19.07 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.508 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.59 -101.96 2.18 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.47 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.426 ' HD2' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.28 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.932 0.396 . . . . 0.0 110.906 179.919 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.778 HG12 HD13 ' A' ' 21' ' ' LEU . 2.8 mp -55.88 -29.46 26.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.769 -179.589 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.23 -56.27 24.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.201 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.02 -32.57 69.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 111.091 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.956 HD23 ' HG ' ' A' ' 60' ' ' LEU . 4.5 mt -70.7 -21.13 62.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.555 -179.667 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -78.1 -57.61 3.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.048 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -58.42 6.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.85 0.357 . . . . 0.0 111.789 -179.138 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -62.2 -25.02 67.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -179.338 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.15 -57.53 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.912 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.77 -54.12 26.01 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.596 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.495 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.5 tm-20 -47.94 -28.38 2.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.033 0.444 . . . . 0.0 111.204 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.012 HD21 HG22 ' A' ' 57' ' ' VAL . 9.2 tp -70.96 -40.58 71.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.3 -179.563 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -61.88 -58.33 8.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.604 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -51.42 -28.04 11.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.386 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.0 -28.66 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.88 -179.955 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.511 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.8 mt -75.18 -31.61 24.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.673 179.654 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -69.77 -31.45 69.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.392 179.642 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -75.61 -29.47 59.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.483 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.6 mt -56.82 -178.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.954 179.975 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.98 -72.14 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.48 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.36 -138.21 4.19 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.494 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.06 174.56 54.89 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.528 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 101.31 -68.4 0.43 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.553 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -95.04 -21.2 18.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.821 0.343 . . . . 0.0 111.069 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.674 ' CG2' HG22 ' A' ' 4' ' ' VAL . 14.9 p -50.7 -29.55 7.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.53 -179.973 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -72.06 -29.91 64.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.158 -179.863 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -67.4 -57.25 6.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 -179.821 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.509 ' O ' HG23 ' A' ' 57' ' ' VAL . 43.6 t -59.61 -25.92 33.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.53 -37.08 85.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.95 0.405 . . . . 0.0 110.472 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.04 -27.87 62.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.719 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.98 -29.01 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.031 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.012 HG22 HD21 ' A' ' 37' ' ' LEU . 22.3 t -83.23 -25.69 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.177 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -75.2 -28.34 59.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.506 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -39.44 59.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.646 -179.088 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.956 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -77.25 -24.88 51.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.54 0.21 . . . . 0.0 111.52 -179.566 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -55.01 13.07 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.008 0.432 . . . . 0.0 110.283 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.94 -26.92 68.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.976 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.8 mt-10 -60.45 -51.33 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.026 -179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.861 ' CG1' HD22 ' A' ' 30' ' ' LEU . 24.4 mt -59.39 -25.68 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -34.68 75.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.833 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.4 -64.35 0.98 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.756 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.75 HD13 HD11 ' A' ' 21' ' ' LEU . 2.4 pp . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.132 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.692 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -119.11 147.68 43.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -107.45 -61.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.855 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.67 -37.23 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.179 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -27.57 63.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.81 179.829 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.096 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.551 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.4 OUTLIER -70.7 -30.93 67.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.173 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.565 ' HG2' HG21 ' A' ' 41' ' ' ILE . 33.2 mt-10 -83.16 -39.71 20.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.605 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -19.71 64.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.147 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.67 -55.13 9.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.63 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.0 t -62.56 -29.34 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.52 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -36.98 75.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.654 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.75 -23.87 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.566 0.698 . . . . 0.0 109.721 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.699 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -66.61 -25.09 66.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.919 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 30.3 tt0 -79.12 -52.71 7.82 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.438 -179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -47.36 -30.23 3.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.837 0.351 . . . . 0.0 111.329 -179.647 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.571 ' HD3' HG21 ' A' ' 64' ' ' ILE . 15.5 tttm -76.19 -36.86 58.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.011 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.648 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 24.9 t -78.21 -54.22 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.35 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -50.53 -29.83 11.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.44 -179.493 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.35 -12.83 36.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.444 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.786 HD11 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -60.74 2.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.945 -179.907 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.09 -95.09 0.24 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.528 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.547 ' C ' HD12 ' A' ' 27' ' ' ILE . . . 174.25 176.52 42.71 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.516 -179.93 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.03 -114.29 0.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.487 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -115.34 -72.48 0.52 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.505 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.793 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.68 -27.7 59.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.888 0.375 . . . . 0.0 111.099 -179.973 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.547 HD12 ' C ' ' A' ' 23' ' ' GLY . 36.2 mt -68.29 -29.6 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.05 -56.12 17.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.702 -179.42 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -57.86 -35.95 71.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 0.0 111.223 -179.579 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 64.9 mt -70.72 -21.32 62.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.691 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -75.28 -59.14 2.88 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -51.97 41.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.196 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.459 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 5.1 ttpt -67.55 -24.93 65.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.413 . . . . 0.0 112.084 -179.198 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.91 -57.74 11.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.951 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.66 -54.09 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.055 -178.704 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.487 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 5.9 tt0 -48.25 -28.57 3.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.075 0.464 . . . . 0.0 111.103 -179.826 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.992 HD21 HG22 ' A' ' 57' ' ' VAL . 8.4 tp -69.47 -40.29 77.2 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.186 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -58.13 9.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.358 -179.769 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -54.65 -29.44 52.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.293 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.45 -26.82 68.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.0 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 44' ' ' LEU . 8.2 mt -75.39 -30.2 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 110.819 179.776 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.11 -45.8 83.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.616 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -62.14 -38.87 90.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.378 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.936 HD11 HG21 ' A' ' 53' ' ' VAL . 11.0 mt -51.19 173.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.072 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -137.94 -76.82 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.553 -179.912 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 173.73 54.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.507 179.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.83 -117.2 2.15 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.48 179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -106.66 -25.23 6.34 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.622 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.83 -27.67 60.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.702 0.287 . . . . 0.0 111.035 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 16.1 t -54.91 -23.89 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.341 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -72.36 -34.96 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.012 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -66.6 -57.32 7.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.936 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -57.55 -25.95 25.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.342 179.928 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.551 ' HG2' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -66.0 -37.74 86.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.921 0.391 . . . . 0.0 110.62 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.37 -27.89 62.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.859 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -71.07 -28.89 64.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.992 HG22 HD21 ' A' ' 37' ' ' LEU . 21.5 t -83.32 -25.98 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -75.46 -28.61 59.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.795 -179.49 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -39.96 63.05 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -178.91 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.38 -26.21 46.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.228 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -40.35 70.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.969 0.414 . . . . 0.0 110.892 -179.789 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -76.48 -26.83 55.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.227 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.578 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.51 -59.28 4.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.153 -179.739 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.644 HD13 HG22 ' A' ' 18' ' ' VAL . 38.7 mt -51.97 -27.95 9.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -62.17 -33.15 73.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.33 -52.41 27.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.858 179.984 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.793 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.937 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.648 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.17 88.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.972 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -75.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.932 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.754 HG22 HG11 ' A' ' 50' ' ' VAL . 21.3 t -83.0 -46.7 18.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.243 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -54.67 -31.37 57.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.819 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -83.18 -25.87 31.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.852 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER -63.81 -30.96 71.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.149 -179.896 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -71.32 -33.89 70.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 2.0 pt-20 -77.21 -19.53 56.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.509 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.58 -39.07 32.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.814 -179.232 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.424 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.1 t -79.16 -29.55 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -65.51 -34.68 78.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.054 0.454 . . . . 0.0 110.087 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.63 -25.07 35.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.606 178.463 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.649 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.7 tt -66.55 -25.6 66.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.863 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -76.77 -46.33 25.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.018 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -51.75 -27.05 10.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.02 -43.85 42.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.069 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.62 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.3 t -76.78 -57.45 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.258 -179.807 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -53.06 -23.83 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.236 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -18.14 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.125 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.784 HD12 ' N ' ' A' ' 22' ' ' GLY . 1.2 pp -103.15 171.31 7.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.941 179.875 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.784 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -178.54 146.04 7.16 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.519 179.871 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.71 87.31 1.87 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.574 179.985 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.96 134.89 2.26 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.577 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.16 -38.95 95.21 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.582 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.766 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.03 -27.65 54.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.322 . . . . 0.0 111.13 -179.947 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' CD1' ' A' ' 21' ' ' LEU . 53.7 mt -65.08 -29.64 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.479 -179.63 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -64.15 -56.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.697 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.13 -28.02 67.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.693 0.282 . . . . 0.0 111.328 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.709 ' O ' HD11 ' A' ' 60' ' ' LEU . 88.5 mt -76.5 -21.62 55.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.639 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -78.22 -59.52 2.74 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.42 -36.96 46.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.829 -179.258 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.704 ' HE2' HD12 ' A' ' 60' ' ' LEU . 2.6 ttpt -82.19 -24.81 34.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.141 -179.152 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.12 -57.88 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.479 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -42.46 79.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.564 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.85 -28.2 67.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.096 0.474 . . . . 0.0 110.918 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.087 HD21 HG22 ' A' ' 57' ' ' VAL . 7.0 tp -69.04 -44.74 72.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.554 -179.29 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -59.88 -58.25 9.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.777 0.322 . . . . 0.0 111.544 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -54.31 -27.81 38.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.22 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 1.7 tptp -67.63 -25.98 66.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.057 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 44' ' ' LEU . 7.2 mt -77.1 -34.01 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.86 0.362 . . . . 0.0 110.48 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.6 -30.81 71.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.385 179.391 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.8 pt-20 -78.01 -29.45 49.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.477 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.859 HD11 HG21 ' A' ' 53' ' ' VAL . 14.6 mt -58.82 154.27 15.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 -179.92 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.78 -98.84 2.46 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.584 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -152.31 97.41 0.17 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.523 -180.0 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.8 147.15 8.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.449 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.26 -94.23 1.54 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.531 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.267 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.754 HG11 HG22 ' A' ' 4' ' ' VAL . 21.5 t -68.29 -19.7 24.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.445 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -76.94 -26.48 54.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.331 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -57.14 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 0.0 110.591 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.859 HG21 HD11 ' A' ' 44' ' ' LEU . 21.3 t -54.04 -31.98 22.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -59.17 -38.99 81.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.983 0.42 . . . . 0.0 110.616 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -71.88 -27.69 63.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.743 179.631 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -67.1 -28.62 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.087 HG22 HD21 ' A' ' 37' ' ' LEU . 11.0 t -82.38 -25.6 8.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.037 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.19 60.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.466 -179.619 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.19 -40.48 52.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -178.919 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.709 HD11 ' O ' ' A' ' 30' ' ' LEU . 1.1 tt -77.0 -24.83 52.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.23 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.69 -54.63 11.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.02 0.438 . . . . 0.0 110.483 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -63.61 -26.96 68.92 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.961 179.779 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.595 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.9 tm-20 -61.27 -58.71 7.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.048 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.573 HD13 HG22 ' A' ' 18' ' ' VAL . 32.1 mt -54.08 -27.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.197 179.843 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -32.9 74.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -56.73 6.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.701 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.766 HD22 ' CG ' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.953 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.62 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 m -113.28 140.3 48.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.837 0.351 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -55.69 0.18 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.86 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.972 HG22 HG21 ' A' ' 50' ' ' VAL . 21.2 t -83.1 -32.21 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.126 -179.846 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -58.05 -33.53 69.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.77 -25.86 34.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.16 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.482 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.1 tt -63.38 -30.02 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.047 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.02 -33.7 68.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.263 -179.759 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.25 -19.94 55.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.473 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -45.52 65.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.46 -179.348 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.669 HG22 HG13 ' A' ' 57' ' ' VAL . 22.0 t -78.38 -29.18 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 -179.394 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -35.6 81.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.141 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -26.59 35.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.476 0.655 . . . . 0.0 109.62 178.711 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.626 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -64.38 -25.39 68.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.913 179.557 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.86 -45.51 24.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.0 -26.82 11.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.903 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -48.6 19.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.655 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.3 t -70.9 -56.04 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.58 -20.49 8.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.05 -16.01 27.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.633 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.762 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp -100.44 -36.92 9.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.764 0.316 . . . . 0.0 111.002 -179.86 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.59 -146.53 18.84 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.76 179.79 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.61 156.39 26.97 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.548 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 141.36 126.53 2.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.578 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.96 -130.35 33.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.492 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.434 ' HG2' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -53.4 -27.84 26.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 -179.915 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.762 HG21 HD11 ' A' ' 21' ' ' LEU . 16.7 mt -68.79 -29.64 44.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.442 -179.485 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.91 -56.07 17.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.527 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -55.95 -26.9 50.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 -179.722 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.691 HD22 ' HG ' ' A' ' 60' ' ' LEU . 56.1 mt -81.09 -21.14 40.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.785 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -74.43 -54.42 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.722 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -54.55 -52.11 63.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.752 0.311 . . . . 0.0 111.761 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.9 ttpp -66.69 -25.08 66.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.924 -179.408 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.75 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.067 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.99 -56.16 11.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.127 -178.593 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.516 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 20.3 tt0 -47.85 -28.5 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 111.348 -179.688 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.04 HD21 HG22 ' A' ' 57' ' ' VAL . 6.2 tp -68.99 -38.68 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.472 -179.459 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -66.38 -58.26 5.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.399 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -52.19 -28.02 16.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.449 -179.629 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -69.34 -25.91 64.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mt -77.8 -34.91 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 110.734 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.93 -29.67 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 179.719 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -78.5 -30.89 47.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 110.575 179.734 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.5 mt -59.33 167.86 1.7 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.869 179.985 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -145.98 -47.02 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.388 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -176.3 41.69 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.447 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.86 -119.76 5.85 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.492 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -131.2 18.54 4.98 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.62 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.718 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.2 tt0 -95.13 -25.83 16.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.781 0.324 . . . . 0.0 110.922 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.972 HG21 HG22 ' A' ' 4' ' ' VAL . 14.8 p -53.05 -30.17 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.281 -179.904 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -67.64 -38.57 84.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -60.18 -57.19 13.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.993 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.705 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -56.78 -25.87 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.975 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.471 ' HG2' HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.72 -38.53 89.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.883 0.373 . . . . 0.0 110.592 179.853 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.36 -27.86 63.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.804 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.62 -28.9 65.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.06 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.04 HG22 HD21 ' A' ' 37' ' ' LEU . 23.0 t -83.12 -25.82 7.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.42 -28.49 59.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.668 -179.538 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.84 -40.52 63.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.875 -178.992 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.691 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.18 -25.83 47.36 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.238 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -71.79 -40.05 69.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.945 0.403 . . . . 0.0 110.794 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.38 -26.88 56.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.272 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.613 ' OE1' HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -63.87 -59.11 4.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -179.68 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.752 HG23 HD11 ' A' ' 67' ' ' LEU . 35.3 mt -51.87 -26.48 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.236 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -31.65 69.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -70.77 -57.38 4.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.766 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.752 HD11 HG23 ' A' ' 64' ' ' ILE . 4.2 pp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.014 -179.957 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.655 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.551 -0.22 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.1 t -160.6 122.33 3.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.806 0.336 . . . . 0.0 110.905 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.67 -58.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 -179.927 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.413 HG11 ' O ' ' A' ' 45' ' ' GLY . 9.4 p -71.32 -27.97 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.61 -36.73 69.76 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.837 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.406 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -74.69 -25.81 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.998 179.787 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER -68.07 -28.43 67.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.153 -179.969 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.47 -31.84 58.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.536 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -77.29 -23.92 51.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.552 -179.682 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -55.2 14.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 111.338 -179.393 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.698 HG22 HG13 ' A' ' 57' ' ' VAL . 21.7 t -70.03 -28.96 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.519 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.0 -36.14 78.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.463 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.33 -24.42 39.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.513 0.673 . . . . 0.0 109.445 178.67 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.563 HD21 HD23 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -66.15 -25.22 66.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.938 179.361 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.444 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.4 tt0 -70.7 -47.04 61.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.24 -179.373 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -50.05 -26.58 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.216 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -76.1 -43.74 41.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.536 -179.775 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.6 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.7 t -78.13 -43.48 27.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.409 -179.498 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.7 mtpt -49.79 -36.52 26.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.028 0.442 . . . . 0.0 110.737 179.777 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.47 -10.95 35.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.795 179.294 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 1.024 HD21 HD12 ' A' ' 67' ' ' LEU . 4.8 tp -72.51 -46.9 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.105 -179.56 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.537 ' O ' HG21 ' A' ' 27' ' ' ILE . . . 110.92 -137.66 14.45 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.596 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -160.34 178.35 36.41 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.983 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 148.06 -77.47 0.24 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.528 -179.995 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.31 -88.76 0.59 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.504 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.944 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.41 -27.89 64.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.845 0.355 . . . . 0.0 110.988 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.537 HG21 ' O ' ' A' ' 22' ' ' GLY . 44.1 mt -73.37 -29.83 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.13 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -65.68 -56.18 13.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.586 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.03 -36.03 74.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.865 0.364 . . . . 0.0 111.281 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.712 HD22 ' HG ' ' A' ' 60' ' ' LEU . 96.6 mt -70.7 -21.62 62.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.833 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.47 -57.25 4.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -54.83 -42.33 71.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.217 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -73.26 -25.45 60.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.638 -179.502 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.12 -57.81 10.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.938 0.399 . . . . 0.0 111.913 -179.167 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.37 -53.22 38.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.929 -178.801 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.49 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.2 tt0 -49.21 -28.55 4.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 111.176 -179.815 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.979 HD21 HG22 ' A' ' 57' ' ' VAL . 4.2 tp -71.44 -38.79 71.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.501 -179.522 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -58.34 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.73 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.43 -28.13 12.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.476 -179.512 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.415 ' CD ' HG22 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -69.44 -28.66 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.974 -179.876 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 HD22 ' A' ' 7' ' ' LEU . 7.2 mt -75.77 -31.92 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.896 0.379 . . . . 0.0 110.506 179.707 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -68.1 -31.88 71.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.385 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -75.8 -29.75 58.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.421 179.496 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.896 HD11 HG21 ' A' ' 53' ' ' VAL . 14.1 mt -66.7 179.29 1.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.982 179.971 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.413 ' O ' HG11 ' A' ' 4' ' ' VAL . . . -134.07 -74.61 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.89 109.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.441 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.49 ' H ' HG21 ' A' ' 50' ' ' VAL . . . 79.82 170.0 39.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 79.88 -106.86 2.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.397 -179.987 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.49 -24.31 67.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.706 0.288 . . . . 0.0 111.038 179.988 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.49 HG21 ' H ' ' A' ' 47' ' ' GLY . 21.5 t -54.2 -24.1 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -66.74 -36.75 83.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -70.65 -57.11 5.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.878 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 44' ' ' LEU . 20.6 t -50.24 -26.34 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.465 -179.931 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.2 -32.67 74.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -27.95 47.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.725 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -68.66 -28.87 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.979 HG22 HD21 ' A' ' 37' ' ' LEU . 30.9 t -83.14 -25.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.811 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -74.04 -28.1 61.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.51 -179.609 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -39.41 63.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.041 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.0 -25.75 48.18 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.165 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -46.59 64.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.949 0.404 . . . . 0.0 110.88 -179.86 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -71.79 -26.98 62.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.416 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 30' ' ' LEU . 1.3 mm-40 -62.71 -59.18 5.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.031 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.45 HG12 HD13 ' A' ' 30' ' ' LEU . 38.1 mt -51.22 -28.13 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.289 179.957 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -29.76 68.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 -179.966 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -69.38 -38.44 78.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.097 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 1.024 HD12 HD21 ' A' ' 21' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.946 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.6 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.88 32.71 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.963 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 -142.3 -56.01 0.44 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.906 179.953 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.33 -22.88 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.351 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -55.72 -38.48 69.8 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.19 -25.94 39.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.308 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.638 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER -64.24 -27.28 68.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.062 -179.989 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -74.3 -33.23 63.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.137 -179.8 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.19 -20.11 55.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.357 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.77 -43.13 38.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.333 -179.559 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.658 HG12 ' HE2' ' A' ' 38' ' ' LYS . 21.9 t -74.62 -29.06 22.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.706 -179.568 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -36.43 81.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.018 0.437 . . . . 0.0 110.352 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -23.85 37.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.548 0.689 . . . . 0.0 109.514 178.518 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.615 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -66.64 -25.06 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.054 179.527 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.418 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 54.0 tt0 -76.33 -50.63 13.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.309 -179.463 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -51.7 -26.18 8.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.783 0.325 . . . . 0.0 111.074 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -41.55 49.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.677 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 11.7 t -78.14 -51.81 17.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.19 -179.979 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.5 -31.6 10.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.464 -179.649 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.96 -10.84 37.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.52 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.727 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -67.81 -69.46 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.823 0.344 . . . . 0.0 110.987 -179.932 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 137.45 -127.43 3.96 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.446 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -152.61 -177.94 26.75 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.538 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.61 -42.68 0.96 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.494 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 167.32 -65.58 0.19 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.437 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -37.53 77.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.897 0.38 . . . . 0.0 110.932 179.833 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.67 HG12 HD13 ' A' ' 21' ' ' LEU . 4.0 mt -71.19 -29.5 36.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.526 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -62.25 -56.21 20.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.7 -179.363 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.1 -51.29 70.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.959 0.409 . . . . 0.0 111.466 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.743 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.1 mt -58.4 -21.09 49.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.122 -179.128 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -74.09 -59.04 2.91 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -178.965 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -45.41 62.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.927 -179.234 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.417 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.23 -24.93 61.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.024 -179.167 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.16 -57.86 9.13 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.694 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.21 81.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.936 -178.644 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -56.79 -28.03 60.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.105 0.479 . . . . 0.0 110.889 179.997 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.062 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -71.34 -41.7 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.287 -179.505 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.658 ' HE2' HG12 ' A' ' 11' ' ' VAL . 20.6 mttm -58.64 -58.3 9.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.675 -179.575 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 13.8 pttt -51.64 -27.77 12.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.685 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 22.8 tttp -73.61 -25.8 60.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.459 -179.562 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.27 -39.11 34.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 111.239 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -63.92 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 179.666 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.46 -30.94 60.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.485 179.609 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.814 HD11 HG21 ' A' ' 53' ' ' VAL . 11.7 mt -60.12 172.36 0.82 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.988 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.64 -61.36 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.548 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 160.18 82.02 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.566 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -146.7 -125.3 1.64 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.445 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -108.18 -1.74 33.58 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.842 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -95.06 -23.39 17.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.799 0.333 . . . . 0.0 111.057 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -51.9 -30.27 12.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.373 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -29.12 65.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.082 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -68.87 -57.24 5.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.984 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.814 HG21 HD11 ' A' ' 44' ' ' LEU . 12.0 t -57.12 -26.91 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.34 -36.1 83.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -73.89 -27.92 61.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.768 179.757 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.44 -29.0 66.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.062 HG22 HD21 ' A' ' 37' ' ' LEU . 16.5 t -83.24 -25.71 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.066 179.935 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -75.11 -28.26 60.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -39.93 61.76 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.132 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.743 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -78.17 -25.73 47.36 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -178.996 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -49.45 47.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.002 0.429 . . . . 0.0 110.644 -179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.06 -26.68 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.099 179.855 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.588 ' CB ' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -62.0 -56.33 20.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 -179.632 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.664 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -57.03 -25.87 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.264 179.969 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -62.58 -31.24 72.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.878 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -69.98 -60.97 1.97 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.926 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.727 ' CD1' HD11 ' A' ' 21' ' ' LEU . 1.6 pp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.026 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.677 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.54 58.42 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.962 0.41 . . . . 0.0 110.831 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -43.95 2.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.454 HG22 HG11 ' A' ' 50' ' ' VAL . 21.3 t -66.39 -34.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.112 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mttm -57.57 -33.93 68.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.688 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.79 -25.46 56.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.011 179.759 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.06 -29.14 66.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.09 -179.845 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HG2' HG21 ' A' ' 41' ' ' ILE . 80.0 mt-10 -79.63 -39.91 30.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.276 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -19.78 63.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.106 -179.946 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -46.75 67.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.069 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.483 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -71.89 -29.06 32.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.604 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 -36.64 80.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.563 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.33 -24.53 37.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.589 0.709 . . . . 0.0 109.712 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -65.9 -25.07 66.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.965 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.458 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -75.67 -41.05 54.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.388 -179.273 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -54.98 -28.12 49.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.307 -179.856 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -48.42 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.487 -179.688 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.667 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.7 t -69.71 -47.77 68.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.491 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 4.3 mtpm? -51.43 -28.76 13.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.232 -179.71 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.11 -10.95 37.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -73.21 -159.69 0.07 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 -179.76 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.485 ' H ' HD13 ' A' ' 27' ' ' ILE . . . -116.65 -118.21 3.01 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.545 179.933 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 174.75 176.05 42.75 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.52 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.62 -28.29 2.55 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.53 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.47 -65.12 0.12 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.416 -179.998 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.601 ' CD ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.51 -62.11 1.95 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.607 HG13 HD22 ' A' ' 67' ' ' LEU . 7.2 mt -60.48 -29.76 45.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.524 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -56.14 26.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.772 0.32 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.83 -30.83 67.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.974 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.952 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.4 mt -70.57 -21.8 62.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.385 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -78.6 -59.32 2.83 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.944 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -53.05 -36.72 60.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.776 0.322 . . . . 0.0 111.828 -179.041 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.743 ' HE3' HD12 ' A' ' 60' ' ' LEU . 7.4 ttpp -82.04 -24.99 35.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.991 -179.321 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.68 -57.81 8.86 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.532 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -42.29 84.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.528 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.89 -28.16 65.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.013 0.435 . . . . 0.0 110.995 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.002 HD21 HG22 ' A' ' 57' ' ' VAL . 2.9 tp -70.41 -47.0 62.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.52 -179.244 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -58.17 9.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 111.411 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -27.92 13.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.441 -179.714 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 5.3 tttp -69.87 -29.6 66.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.036 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.5 mt -75.11 -31.79 25.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.756 179.774 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -31.44 69.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.494 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.89 -29.9 58.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.574 179.667 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.52 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.4 mt -62.36 159.45 15.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.894 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.77 -77.16 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.49 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.69 161.51 28.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.88 -161.03 13.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.457 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -98.76 24.36 32.47 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.644 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.419 ' HG2' HD21 ' A' ' 44' ' ' LEU . 3.8 tt0 -88.95 -27.09 21.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 111.024 179.944 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.454 HG11 HG22 ' A' ' 4' ' ' VAL . 21.4 t -55.63 -23.2 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.415 179.938 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.2 tttt -72.9 -32.47 65.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.943 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -65.93 -57.17 8.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.837 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.7 t -57.8 -28.05 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 179.883 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.67 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.945 0.402 . . . . 0.0 110.617 179.812 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -68.67 -27.86 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.784 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -70.26 -28.76 65.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.028 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.002 HG22 HD21 ' A' ' 37' ' ' LEU . 12.2 t -82.11 -25.81 9.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -75.18 -28.64 60.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.259 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -37.48 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.613 -179.229 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.952 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.2 tt -76.59 -27.69 55.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.405 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -56.18 11.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.051 0.453 . . . . 0.0 110.49 179.868 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -62.65 -26.87 68.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.821 179.626 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.826 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.91 -44.54 97.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.956 -179.92 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 13.9 mt -67.35 -24.26 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 110.885 179.505 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -33.87 76.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -62.32 -62.77 1.53 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.769 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.616 HD21 ' CD1' ' A' ' 30' ' ' LEU . 1.1 pp . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.667 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.6 t -114.71 103.37 10.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.817 -179.912 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.67 -31.51 69.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.927 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.487 HG12 HG22 ' A' ' 41' ' ' ILE . 14.6 t -69.41 -40.11 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.017 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -56.27 -32.61 64.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.708 179.919 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.88 -25.82 48.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.895 179.783 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -28.12 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.239 -179.961 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.445 ' HG3' HG21 ' A' ' 41' ' ' ILE . 84.1 mt-10 -77.2 -33.62 56.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.405 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.22 -24.58 59.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.104 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -70.42 -52.0 25.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.503 HG22 ' CG1' ' A' ' 57' ' ' VAL . 26.1 t -63.65 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 -179.976 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -38.21 70.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.55 -28.85 46.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.544 0.688 . . . . 0.0 109.485 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.712 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.8 tt -59.75 -25.22 64.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.812 179.121 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.438 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.6 tt0 -77.73 -43.52 30.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.305 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -52.28 -30.98 30.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.179 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -76.06 -37.23 58.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.294 -179.835 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.663 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 20.2 t -78.1 -53.46 14.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.626 -179.594 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.438 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -49.77 -30.11 8.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.499 -179.468 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.8 -12.88 37.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.436 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.732 HD11 HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -65.34 -69.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.014 -179.984 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 159.55 -95.73 0.14 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.484 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.407 ' N ' HD13 ' A' ' 27' ' ' ILE . . . 150.35 135.24 2.37 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.501 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.47 117.69 2.43 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.483 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.94 -123.42 6.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.554 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.735 ' HG2' HD13 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -58.5 -27.58 64.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 111.062 -179.981 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.41 HG12 HD13 ' A' ' 21' ' ' LEU . 37.5 mt -70.74 -29.56 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.499 -179.597 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.07 -56.27 16.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.815 -179.156 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.73 -38.66 82.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.4 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.71 ' O ' HD11 ' A' ' 60' ' ' LEU . 80.0 mt -67.78 -21.37 65.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.841 -179.369 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.08 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.59 -43.16 65.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 0.0 111.778 -179.279 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 60' ' ' LEU . 7.1 ttpt -74.73 -24.95 58.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.908 -179.288 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -57.98 8.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.746 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.81 -51.33 34.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.814 -178.709 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.462 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.7 tt0 -50.86 -28.24 9.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.884 179.904 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.042 HD21 HG22 ' A' ' 57' ' ' VAL . 9.6 tp -70.26 -41.81 72.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.424 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.07 -58.23 9.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.647 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -52.97 -27.77 20.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.347 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 3.7 tppp? -70.46 -25.67 63.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.487 HG22 HG12 ' A' ' 4' ' ' VAL . 7.5 mt -76.71 -36.95 27.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 0.0 111.083 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -67.95 -29.63 68.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.764 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -77.66 -29.95 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.15 0.5 . . . . 0.0 110.551 179.552 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.545 HD21 ' HG2' ' A' ' 49' ' ' GLU . 4.2 mt -53.47 162.34 0.82 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.152 -179.976 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -142.75 -102.98 0.45 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.455 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.94 -176.74 14.53 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.533 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -116.41 5.55 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.413 179.938 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.85 27.15 2.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.8 tt0 -90.63 -28.08 18.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.1 -20.26 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.469 -179.958 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -32.16 64.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.215 -179.826 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.2 ttpp -67.95 -57.3 6.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.557 ' O ' HG23 ' A' ' 57' ' ' VAL . 51.4 t -58.99 -25.98 31.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.044 179.959 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -37.99 88.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.504 179.798 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -71.31 -28.77 64.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.684 179.722 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.66 -28.89 66.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.912 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.042 HG22 HD21 ' A' ' 37' ' ' LEU . 18.7 t -83.06 -25.69 8.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.013 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -28.36 60.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.568 -179.606 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -38.73 58.11 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.078 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.826 HD12 ' HE2' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -77.58 -25.55 50.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.256 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.13 -54.99 10.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.01 0.433 . . . . 0.0 110.509 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.8 -26.92 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.526 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.45 -59.11 5.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.17 -179.666 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.539 HD13 HG22 ' A' ' 18' ' ' VAL . 36.6 mt -52.73 -27.45 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.387 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -64.75 -29.87 70.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.916 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -75.08 -31.04 61.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.017 -179.925 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.735 HD13 ' HG2' ' A' ' 26' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.894 179.953 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.663 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.134 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t -59.45 -26.98 65.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.803 0.335 . . . . 0.0 111.06 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.0 mmt85 -57.21 -57.27 13.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -73.49 -37.66 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.2 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 mttt -57.06 -32.93 66.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.06 -25.91 31.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.166 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.652 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -65.75 -27.79 68.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.744 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.42 ' HG3' HG21 ' A' ' 41' ' ' ILE . 32.1 mt-10 -78.67 -38.34 39.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.458 -179.452 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -19.86 62.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.534 -179.633 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -73.06 -53.7 10.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 -179.734 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 57' ' ' VAL . 21.8 t -63.89 -29.31 46.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.72 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -58.57 -37.06 74.95 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.727 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.22 -23.91 40.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.582 0.706 . . . . 0.0 109.463 178.73 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.616 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.23 -25.22 67.59 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.946 179.36 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -74.24 -42.1 60.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.117 -179.38 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -56.81 -26.02 57.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.176 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -51.88 11.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.432 -179.768 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.674 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 8.5 t -68.12 -47.79 76.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.446 -179.697 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.5 mtpt -50.81 -27.16 6.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.327 -179.704 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.13 -10.86 37.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.533 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.996 HD11 HD13 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.19 -157.49 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.667 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.431 ' H ' HD22 ' A' ' 21' ' ' LEU . . . 138.33 135.99 3.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.47 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.02 95.75 1.98 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.556 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.57 179.16 16.94 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.507 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.53 -31.52 4.24 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.461 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -27.64 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.814 0.34 . . . . 0.0 111.023 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.641 HG12 HD13 ' A' ' 21' ' ' LEU . 23.8 mt -68.55 -29.67 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.459 -179.537 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.96 -56.15 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.64 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.18 -30.43 70.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 111.281 -179.497 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.729 ' O ' HD11 ' A' ' 60' ' ' LEU . 95.0 mt -73.6 -21.35 60.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.491 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -78.06 -59.4 2.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.728 -179.345 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -33.59 59.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.793 0.33 . . . . 0.0 111.566 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -81.96 -24.89 35.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.813 -179.521 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -65.71 -58.05 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.766 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.9 -41.94 74.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.878 -178.832 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.5 -28.27 66.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.037 0.446 . . . . 0.0 110.789 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.098 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -70.26 -40.75 74.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.461 -179.41 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -61.72 -58.32 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.599 -179.462 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -50.59 -28.27 8.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.559 -179.601 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -69.79 -28.42 65.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.87 -179.995 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.42 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.3 mt -76.2 -30.26 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.586 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.89 -33.34 73.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.244 179.468 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.494 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -74.5 -30.61 61.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.342 179.61 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.909 HD11 HG21 ' A' ' 53' ' ' VAL . 13.3 mt -61.25 168.75 2.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.843 179.953 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -138.85 -95.53 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.545 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.29 -142.98 7.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.471 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -90.58 -175.97 44.44 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.562 179.914 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 101.76 -82.88 0.47 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.497 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.431 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.4 tp10 -66.4 -15.04 62.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.634 0.254 . . . . 0.0 111.246 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.32 -18.85 12.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.625 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -74.65 -29.88 61.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.201 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -78.0 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.089 -179.782 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.909 HG21 HD11 ' A' ' 44' ' ' LEU . 17.1 t -57.23 -25.86 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.29 -179.993 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.8 -35.17 79.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.392 . . . . 0.0 110.55 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -75.18 -27.67 59.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.739 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -69.29 -30.77 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.115 -179.827 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.098 HG22 HD21 ' A' ' 37' ' ' LEU . 9.6 t -83.3 -25.57 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.183 -179.958 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.98 -27.97 60.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.579 -179.524 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -76.06 -39.54 55.23 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -178.943 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.729 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -77.97 -25.26 48.03 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.273 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -52.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.05 0.452 . . . . 0.0 110.715 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -66.5 -26.92 67.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.225 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.678 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.4 tm-20 -61.89 -56.12 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.665 HG23 HD11 ' A' ' 67' ' ' LEU . 30.0 mt -56.15 -26.8 22.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.045 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -34.22 75.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.81 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.7 mmtt -67.2 -59.74 3.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.606 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.996 HD13 HD11 ' A' ' 21' ' ' LEU . 3.7 pp . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.019 179.819 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.674 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.415 -0.274 . . . . 0.0 112.415 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.3 t -128.8 -64.67 0.91 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -65.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.868 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.427 HG22 HG11 ' A' ' 50' ' ' VAL . 21.5 t -63.38 -29.46 47.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.217 179.979 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -57.0 -35.78 69.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.958 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.04 -25.96 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.102 179.837 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.3 tt -62.67 -27.74 69.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.03 179.989 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -73.87 -32.99 63.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.17 -20.21 55.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.341 -179.84 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -51.13 48.05 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.894 0.378 . . . . 0.0 111.101 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.498 HG22 HG13 ' A' ' 57' ' ' VAL . 24.4 t -72.7 -29.19 29.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.44 -179.783 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -61.44 -36.57 80.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.406 179.985 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.26 -24.01 37.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.499 0.666 . . . . 0.0 109.56 178.623 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.503 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -66.01 -25.21 66.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.883 179.403 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.405 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.2 tt0 -75.36 -47.78 26.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.221 -179.585 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -50.25 -28.23 7.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.157 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -76.11 -41.71 49.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.342 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.627 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.5 t -75.46 -55.08 12.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.422 -179.705 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 6.0 mtpt -50.82 -29.33 11.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.357 -179.661 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.08 -11.68 35.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.4 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.64 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -68.49 -69.64 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.928 -179.965 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.39 -131.53 3.52 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.492 -179.965 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.53 136.28 6.61 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.437 -179.957 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.18 -171.52 43.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.556 179.979 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -70.55 0.97 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.481 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.779 ' NE ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.1 -27.82 47.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 0.0 111.102 -179.913 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 71.4 mt -76.25 -29.58 19.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.291 -179.604 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -68.39 -45.76 71.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.184 -179.752 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -69.19 -29.35 67.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.389 . . . . 0.0 110.818 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.879 HD21 ' HB3' ' A' ' 63' ' ' GLU . 24.1 mt -74.53 -21.89 59.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.293 -179.841 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.65 -59.34 2.82 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.878 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -50.42 -56.85 9.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.647 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.618 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -63.8 -24.99 67.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.18 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.44 -57.62 11.46 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.659 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.2 OUTLIER -68.96 -54.49 15.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.588 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.498 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.3 tt0 -47.78 -28.75 2.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.031 0.443 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.987 HD21 HG22 ' A' ' 57' ' ' VAL . 3.0 tp -69.81 -38.37 76.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.197 -179.733 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.401 ' HZ2' HG12 ' A' ' 11' ' ' VAL . 17.4 mttp -63.62 -58.2 7.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.312 -179.705 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -50.66 -27.95 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.29 -179.854 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -70.56 -28.43 64.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.862 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.0 mt -74.07 -31.94 31.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.99 0.424 . . . . 0.0 110.58 179.614 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -67.86 -35.83 79.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.327 179.516 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -71.59 -29.37 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 179.568 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.614 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.1 mt -62.98 164.35 8.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.921 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -141.03 -99.8 0.39 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.566 -179.998 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.435 ' O ' HG21 ' A' ' 50' ' ' VAL . . . -74.5 -93.97 0.13 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.587 179.989 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -136.95 -142.36 4.41 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.505 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.16 -88.87 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 -179.924 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -62.45 -26.18 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 179.976 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.556 HG22 HD22 ' A' ' 44' ' ' LEU . 25.1 t -54.89 -24.02 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.387 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -71.17 -29.44 65.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.013 -179.985 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.8 tptt -71.17 -57.26 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.89 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.614 ' CG2' HD11 ' A' ' 44' ' ' LEU . 25.0 t -55.49 -27.66 21.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.936 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.97 -31.84 73.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 110.649 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -79.55 -27.77 41.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -68.87 -28.73 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.319 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.987 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.1 -25.52 8.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.15 -28.53 60.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.442 -179.66 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -40.46 52.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.742 -179.149 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.783 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -76.2 -25.1 54.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.589 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -55.96 9.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.21 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.52 -26.79 68.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -60.59 -50.01 75.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.992 -179.919 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.617 HG12 HD13 ' A' ' 30' ' ' LEU . 14.2 mt -68.19 -22.79 27.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.784 179.452 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -38.74 67.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.383 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -93.91 -66.21 0.93 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.977 0.418 . . . . 0.0 110.733 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.779 HD23 ' NE ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.972 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.627 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.27 87.06 0.81 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.791 0.329 . . . . 0.0 110.903 -179.968 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.5 mtt180 -101.07 -60.39 1.53 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.958 -179.932 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 1.045 HG22 HG21 ' A' ' 50' ' ' VAL . 16.8 t -83.08 -50.54 15.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 -179.828 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -52.76 -30.48 32.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.892 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.55 -25.6 33.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.141 179.951 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.831 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -67.03 -29.13 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.391 -179.644 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -78.05 -33.48 50.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.556 -179.397 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -19.8 56.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.77 0.319 . . . . 0.0 111.67 -179.743 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -47.38 23.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.796 -179.166 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.628 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.6 t -74.79 -29.12 22.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.907 -179.264 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 ttpp -63.25 -36.25 83.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.324 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.52 -23.86 37.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.57 0.7 . . . . 0.0 109.753 178.722 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.612 HD21 HD23 ' A' ' 60' ' ' LEU . 1.6 tt -68.07 -25.12 65.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.211 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.414 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.1 tt0 -75.0 -51.88 12.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.495 -179.4 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -50.2 -26.98 5.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.322 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -43.87 41.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.21 179.976 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.684 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 21.3 t -76.12 -48.12 29.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.556 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.414 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -49.59 -31.7 11.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.518 -179.552 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.13 -11.04 39.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.505 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.714 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -71.63 -69.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.99 -179.869 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 163.46 -109.02 0.36 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 159.19 123.88 0.73 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.93 136.84 3.45 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.49 179.961 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.35 -109.31 2.06 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.573 179.936 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.539 ' HB3' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.5 -53.22 60.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.901 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.48 HG12 HD13 ' A' ' 21' ' ' LEU . 12.4 mt -60.21 -29.48 44.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.628 -179.473 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -59.09 -56.22 24.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.651 -179.265 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -58.45 -36.89 74.37 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.923 0.392 . . . . 0.0 111.225 -179.574 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.86 HD23 ' HG ' ' A' ' 60' ' ' LEU . 6.5 mt -66.77 -21.79 66.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.887 -179.387 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 tttm -78.63 -59.54 2.74 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.831 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -37.41 56.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -178.921 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.766 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.8 ttpm? -82.25 -24.67 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.204 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.84 -57.81 7.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.494 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -40.85 77.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.67 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.5 tt0 -59.74 -27.78 66.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.13 0.49 . . . . 0.0 110.659 179.869 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 1.061 HD21 HG22 ' A' ' 57' ' ' VAL . 6.8 tp -75.81 -40.02 55.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.66 -179.234 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.81 -33.23 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.842 -179.311 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 4.2 ptmt -79.05 -30.45 44.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.058 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -63.28 -26.0 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.893 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.3 mt -73.55 -30.08 28.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.622 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.7 -35.63 75.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.435 179.519 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -71.71 -28.8 63.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.479 179.603 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.69 HD13 HG23 ' A' ' 50' ' ' VAL . 5.3 mt -57.66 -176.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.988 179.985 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.35 -126.35 1.93 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.535 179.995 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -68.88 -89.09 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.546 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.98 -167.82 11.67 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.47 179.945 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.41 -63.03 3.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.443 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -95.04 -23.31 17.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 1.045 HG21 HG22 ' A' ' 4' ' ' VAL . 14.4 p -54.16 -30.04 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.308 -179.925 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -33.46 74.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.061 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -57.29 12.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.864 -179.837 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.534 ' O ' HG23 ' A' ' 57' ' ' VAL . 39.7 t -55.11 -26.08 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.109 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.78 -34.35 77.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.025 0.441 . . . . 0.0 110.373 179.588 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -76.3 -28.16 56.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.469 179.583 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.23 -28.76 68.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.881 179.826 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 1.061 HG22 HD21 ' A' ' 37' ' ' LEU . 4.5 t -81.81 -25.42 9.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.898 179.885 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.7 -28.47 61.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.263 -179.852 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -74.51 -38.69 62.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.738 -179.373 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.86 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.0 tt -76.58 -26.01 54.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.343 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.36 -56.26 9.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.01 0.433 . . . . 0.0 110.289 179.82 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -61.85 -26.64 68.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.36 179.242 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.805 ' CB ' HD21 ' A' ' 30' ' ' LEU . 3.2 mm-40 -61.16 -45.0 96.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 14.8 mt -68.48 -23.76 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.023 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -34.34 76.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mtpm? -63.37 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.6 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.714 ' CD1' HD11 ' A' ' 21' ' ' LEU . 3.4 pp . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 101' ' ' HTS . . . . . 0.684 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.577 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.698 0.285 . . . . 0.0 111.627 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.01 -32.84 73.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.961 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -77.44 -19.96 55.25 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -50.14 19.09 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 57' ' ' VAL . 25.8 t -74.83 -29.26 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -36.57 81.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -24.22 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.535 0.683 . . . . 0.0 109.547 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.94 -25.11 66.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.954 179.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.423 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.9 tt0 -77.67 -44.46 27.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.168 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -52.31 -27.28 14.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -53.19 8.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.225 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.3 t -64.8 -52.03 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.312 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 12.1 mttt -52.23 -25.65 9.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.448 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.61 -11.04 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.408 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.45 -0.444 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.526 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.49 -27.75 65.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.776 0.322 . . . . 0.0 111.034 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.408 HG12 HD13 ' A' ' 21' ' ' LEU . 33.1 mt -72.73 -29.53 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.442 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -56.17 12.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.804 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.61 -35.98 77.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 111.483 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.666 ' O ' HD11 ' A' ' 60' ' ' LEU . 83.6 mt -71.1 -21.48 62.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.944 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -76.37 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 mttm -54.04 -43.04 69.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.352 . . . . 0.0 111.496 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -72.54 -25.11 61.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.695 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.85 -57.77 8.83 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.805 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.18 -49.15 62.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 33' ' ' LYS . 11.9 pt-20 -54.32 -28.55 43.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 0.0 110.989 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.049 HD21 HG22 ' A' ' 57' ' ' VAL . 8.1 tp -67.72 -41.98 82.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.064 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -58.21 9.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.287 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptpm? -51.11 -28.02 9.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.318 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -70.91 -25.9 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.577 HD13 HD22 ' A' ' 7' ' ' LEU . 6.8 mt -77.84 -30.54 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.824 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -67.45 -41.03 85.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.588 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.422 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.9 pt-20 -66.84 -35.42 80.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.513 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.763 HD11 ' CG2' ' A' ' 53' ' ' VAL . 10.9 mt . . . . . 0 C--N 1.327 -0.403 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.113 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.703 0.287 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 18.3 t -55.37 -22.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.504 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -72.33 -36.08 68.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.097 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -64.83 -57.41 8.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.961 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.763 ' CG2' HD11 ' A' ' 44' ' ' LEU . 28.0 t -57.96 -26.28 28.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.27 -37.32 87.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 110.414 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -71.85 -28.18 63.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.577 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -68.78 -29.46 67.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.872 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.049 HG22 HD21 ' A' ' 37' ' ' LEU . 19.7 t -83.25 -25.55 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.026 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -73.83 -28.26 61.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.522 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -75.37 -44.0 47.34 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.666 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.02 -25.12 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -70.43 -55.3 9.36 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.055 0.455 . . . . 0.0 110.752 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -62.22 -26.81 68.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.214 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -56.74 14.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.413 -179.5 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.569 HG12 HD13 ' A' ' 30' ' ' LEU . 21.5 mt -58.19 -24.57 24.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.345 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -31.76 58.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.515 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp . . . . . 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 111.364 -179.631 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.144 0 CA-C-O 120.739 0.304 . . . . 0.0 111.536 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -61.51 -34.83 76.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.884 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.1 -19.57 56.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.722 0.296 . . . . 0.0 111.604 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.8 -44.51 63.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.671 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.578 HG22 ' CG1' ' A' ' 57' ' ' VAL . 19.3 t -79.1 -29.05 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.913 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -36.53 83.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.248 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.68 -26.66 34.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.545 0.688 . . . . 0.0 109.565 178.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.57 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -64.28 -25.15 67.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.09 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.403 ' HG2' ' CG ' ' A' ' 19' ' ' LYS . 1.2 tm-20 -76.85 -56.06 4.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.341 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.07 -27.91 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.491 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -76.03 -41.62 50.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.345 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 14' ' ' LEU . 22.1 t -76.13 -48.59 27.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.523 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.403 ' CG ' ' HG2' ' A' ' 15' ' ' GLU . 1.7 mtpt -49.16 -32.89 11.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.348 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -11.0 43.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.591 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.529 HD22 HG12 ' A' ' 27' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.83 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.345 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.54 -60.28 3.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.906 0.384 . . . . 0.0 111.05 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.534 ' HA ' HD12 ' A' ' 30' ' ' LEU . 4.1 mt -55.0 -29.64 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.501 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -56.26 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.293 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.39 -28.95 63.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.9 0.381 . . . . 0.0 110.957 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.926 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.2 mt -74.54 -21.56 59.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.539 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.11 -59.2 2.88 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.05 -42.39 49.68 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -80.88 -25.21 37.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.19 -57.57 12.23 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.83 -55.73 15.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.459 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.501 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.4 tt0 -47.94 -28.39 2.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.039 0.447 . . . . 0.0 111.246 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.02 HD21 HG22 ' A' ' 57' ' ' VAL . 12.1 tp -71.41 -38.29 71.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.454 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HD2' HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -64.81 -58.28 6.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.536 -179.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -27.8 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.348 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 1.8 tptt -70.38 -25.58 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.239 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.63 -37.26 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.839 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.25 -29.71 69.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.779 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 4.4 pt-20 -78.4 -30.51 47.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.559 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.784 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.4 mt . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.037 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.784 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.1 tt0 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.755 0.312 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.509 ' HA ' HD13 ' A' ' 44' ' ' LEU . 14.9 p -52.85 -29.39 14.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.427 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.85 87.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.082 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -60.03 -57.09 14.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.066 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.616 ' CG2' HD11 ' A' ' 44' ' ' LEU . 24.4 t -55.79 -25.87 19.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.24 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.84 -37.84 87.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.35 . . . . 0.0 110.556 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.07 -27.98 63.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.795 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -70.61 -28.89 65.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.02 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.25 -25.56 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.054 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -28.64 60.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.4 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -39.67 54.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.926 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.5 tt -75.14 -25.25 58.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.481 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -56.1 8.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.951 0.405 . . . . 0.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.93 -26.96 67.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.869 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.2 mt-10 -61.66 -46.76 88.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 30' ' ' LEU . 17.2 mt -65.26 -24.2 34.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.01 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.31 -31.77 72.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.911 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 180.0 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.833 0.349 . . . . 0.0 111.117 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.501 ' CG ' HG21 ' A' ' 41' ' ' ILE . 20.8 mt-10 -81.93 -43.35 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.364 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -66.41 -19.87 65.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.423 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.67 -53.98 9.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.302 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.472 HG22 ' CG1' ' A' ' 57' ' ' VAL . 36.8 t -60.56 -29.23 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.723 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -37.23 74.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.8 40.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.47 0.653 . . . . 0.0 109.522 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 60' ' ' LEU . 1.3 tt -65.51 -25.12 67.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.915 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.4 tt0 -75.28 -46.43 33.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.098 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.22 -27.71 23.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -41.31 50.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.088 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.567 HG22 HD13 ' A' ' 64' ' ' ILE . 25.3 t -78.14 -51.78 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.579 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -49.82 -31.1 11.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.49 -179.559 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -11.59 38.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.464 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.579 HD22 HG12 ' A' ' 27' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.997 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.36 0 N-CA-C 112.611 -0.196 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -55.47 20.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.041 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.591 HD12 ' H ' ' A' ' 27' ' ' ILE . 4.6 mp -58.5 -29.67 39.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.717 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -56.21 21.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 0.0 111.299 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -26.82 64.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.191 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.884 HD23 ' HG ' ' A' ' 60' ' ' LEU . 5.6 mt -76.66 -21.68 55.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -78.56 -59.35 2.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -39.21 58.32 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.657 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -81.9 -24.96 35.39 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.07 -57.71 10.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.668 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -46.45 71.69 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -53.83 -28.17 34.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 0.0 110.835 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.107 HD21 HG22 ' A' ' 57' ' ' VAL . 8.7 tp -72.03 -41.78 67.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.388 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -58.18 9.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.538 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt -52.96 -28.54 24.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.351 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.414 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -69.15 -29.89 68.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.103 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.501 HG21 ' CG ' ' A' ' 8' ' ' GLU . 8.0 mt -74.47 -31.76 28.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.872 0.368 . . . . 0.0 110.671 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -68.83 -31.95 71.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.534 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -75.26 -29.65 60.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.559 HD22 HG22 ' A' ' 50' ' ' VAL . 6.1 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.969 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.63 0.252 . . . . 0.0 111.117 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.559 HG22 HD22 ' A' ' 44' ' ' LEU . 21.2 t -51.53 -28.04 8.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.796 0.332 . . . . 0.0 111.454 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.74 -29.46 62.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.979 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -63.28 -57.17 11.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 34.5 t -61.12 -29.72 46.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.16 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -63.21 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.703 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -79.06 -27.67 43.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.895 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -69.27 -28.54 66.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.379 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.107 HG22 HD21 ' A' ' 37' ' ' LEU . 7.2 t -83.22 -25.87 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.116 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -75.23 -28.61 59.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -37.85 56.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.676 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.884 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.6 tt -76.93 -25.78 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.118 -0.233 . . . . 0.0 111.439 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.36 -56.08 9.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.988 0.423 . . . . 0.0 110.28 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -62.25 -26.78 68.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.776 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.852 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -60.27 -47.57 85.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.019 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.733 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.4 mt -66.37 -24.01 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.111 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -63.13 -33.99 76.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.717 179.896 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.48 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.146 0 CA-C-O 120.597 0.237 . . . . 0.0 111.496 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -83.06 -32.82 26.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.737 0.303 . . . . 0.0 111.404 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 12' ' ' LYS . 2.3 pp20? -76.2 -19.16 58.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.199 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.87 -46.97 14.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.009 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.64 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.9 t -72.51 -29.51 31.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 9' ' ' GLU . 18.1 ptpt -63.11 -35.42 80.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.934 0.397 . . . . 0.0 110.358 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.5 -23.76 37.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.496 0.665 . . . . 0.0 109.572 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 60' ' ' LEU . 2.4 tt -67.4 -25.22 65.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.004 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.9 tt0 -77.2 -48.47 17.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.247 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.38 -25.88 10.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.188 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -76.06 -45.2 35.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.633 HG22 HD13 ' A' ' 64' ' ' ILE . 2.3 t -75.77 -51.04 21.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.458 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 16.3 mttt -52.2 -30.43 27.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.26 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.0 -11.45 35.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.287 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.028 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 112.836 -0.105 . . . . 0.0 112.836 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -27.91 11.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 111.289 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.419 ' HA ' HD12 ' A' ' 30' ' ' LEU . 59.9 mt -64.59 -29.82 48.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.167 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -59.75 -56.02 26.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.338 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.42 -36.72 71.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 0.0 111.282 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.962 HD23 ' HG ' ' A' ' 60' ' ' LEU . 7.1 mt -67.1 -21.86 65.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.643 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -78.54 -59.1 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -51.89 -59.09 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.816 0.341 . . . . 0.0 111.914 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.451 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -59.92 -24.99 64.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.698 -179.458 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.03 -57.75 11.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -67.25 -55.47 13.86 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.8 OUTLIER -47.98 -28.27 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 0.0 111.18 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 57' ' ' VAL . 10.8 tp -70.51 -41.33 72.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.342 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -58.27 9.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.548 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 10.8 ptmt -52.46 -27.98 18.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.242 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -71.07 -25.82 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.053 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.7 mt -74.07 -31.85 31.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.862 0.363 . . . . 0.0 110.67 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -67.95 -33.56 74.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.335 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -74.66 -28.59 60.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.737 179.612 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB ' ' A' ' 53' ' ' VAL . 7.8 mt . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.108 -179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 CA--C 1.527 0.067 0 CA-C-O 120.728 0.299 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 p -49.46 -27.19 2.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.691 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -26.06 61.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.414 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -77.96 -57.39 3.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.206 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.622 ' O ' HG23 ' A' ' 57' ' ' VAL . 22.3 t -57.5 -25.89 25.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.325 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -38.03 86.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 110.652 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.03 -27.79 62.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -72.06 -28.7 63.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.438 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.23 -27.35 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.224 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -28.71 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.76 -39.08 52.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.939 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.962 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -78.14 -24.94 47.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.632 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -70.43 -54.27 13.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.985 0.422 . . . . 0.0 110.205 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -64.03 -26.85 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.635 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.917 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.6 mm-40 -59.37 -57.7 11.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.834 ' CG1' HD22 ' A' ' 30' ' ' LEU . 29.6 mt -56.14 -25.6 20.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.24 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -28.09 65.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm . . . . . 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.017 -179.898 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.47 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.761 0.315 . . . . 0.0 111.213 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -68.08 -34.14 75.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.295 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -77.06 -19.79 56.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.409 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -42.74 67.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.346 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.442 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.1 t -78.4 -29.31 14.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.6 81.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.043 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.9 37.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.539 0.685 . . . . 0.0 109.59 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.596 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -66.99 -25.33 66.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.905 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.13 -50.7 11.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.091 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -49.42 -27.46 4.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.135 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -76.04 -40.54 53.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.907 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.627 HG22 HD13 ' A' ' 64' ' ' ILE . 16.0 t -78.32 -55.3 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -55.2 -22.08 16.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.64 -16.09 27.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.408 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.581 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp . . . . . 0 C--N 1.332 -0.189 0 CA-C-O 120.89 0.376 . . . . 0.0 110.817 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.568 -0.213 . . . . 0.0 112.568 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -27.76 64.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 111.018 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.4 mt -68.06 -29.8 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.219 -179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.51 -56.12 21.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.178 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.57 -29.51 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.837 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.001 HD21 ' HB3' ' A' ' 63' ' ' GLU . 9.5 mt -72.08 -22.28 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.325 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -78.61 -59.16 2.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -58.87 5.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.794 0.331 . . . . 0.0 111.838 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.744 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.5 ttpm? -60.37 -25.05 65.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.75 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.38 -57.57 11.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.639 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.36 -55.44 10.4 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.546 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.01 -28.62 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.006 0.431 . . . . 0.0 111.141 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.109 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.02 -38.24 75.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.165 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -58.02 8.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.375 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptmt -50.25 -31.78 14.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.378 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.407 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 38.2 tttp -66.76 -25.98 66.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 mt -74.13 -32.41 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 0.0 110.625 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -67.35 -36.34 81.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -71.02 -29.78 65.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.483 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.671 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.1 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.93 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HB3' HD21 ' A' ' 44' ' ' LEU . 7.8 tt0 . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.794 0.331 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.3 p -50.1 -28.33 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.53 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.62 -31.55 67.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.068 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -66.42 -57.25 7.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.671 ' CG2' HD11 ' A' ' 44' ' ' LEU . 18.0 t -58.99 -25.9 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.126 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -38.36 89.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -71.71 -27.88 63.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.638 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -69.75 -28.94 66.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.928 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.109 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.49 -25.45 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.046 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -74.58 -28.38 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.437 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.61 -43.44 48.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.503 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.937 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -72.51 -25.04 61.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.59 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -69.76 -56.14 7.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.936 0.398 . . . . 0.0 110.557 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.49 -26.94 65.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.807 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 1.001 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.32 -48.41 78.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.943 -179.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.671 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.6 mt -65.75 -24.16 33.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.861 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -35.33 76.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.989 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.899 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.917 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.757 0.313 . . . . 0.0 111.283 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.521 ' HG3' HG21 ' A' ' 41' ' ' ILE . 58.1 mt-10 -78.68 -32.57 47.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.639 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -20.47 56.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -74.81 -55.04 6.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.897 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.705 HG22 HG13 ' A' ' 57' ' ' VAL . 12.1 t -63.91 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.267 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -59.23 -36.84 76.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.438 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.407 ' HB1' ' OE2' ' A' ' 16' ' ' GLU . . . -78.95 -23.89 44.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.531 0.682 . . . . 0.0 109.414 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.599 HD21 HD23 ' A' ' 60' ' ' LEU . 2.3 tt -66.85 -24.99 66.2 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.856 -1.066 . . . . 0.0 110.86 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.428 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 34.3 tt0 -74.19 -49.77 22.11 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.63 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.407 ' OE2' ' HB1' ' A' ' 13' ' ' ALA . 1.1 pt-20 -50.71 -26.02 5.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.757 0.313 . . . . 0.0 111.341 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -75.11 -43.91 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.173 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.46 HG22 HD13 ' A' ' 64' ' ' ILE . 3.0 t -77.94 -56.26 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.334 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 22.2 mttt -51.82 -24.11 5.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.301 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.52 -18.81 28.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.142 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.585 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp . . . . . 0 C--N 1.332 -0.192 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.808 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.4 ' HD3' HG13 ' A' ' 27' ' ' ILE . 0.2 OUTLIER -56.56 -27.63 58.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.104 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.409 HD13 ' CD1' ' A' ' 21' ' ' LEU . 61.4 mt -74.19 -29.69 25.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.502 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -56.15 15.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.759 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -61.19 -37.58 83.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.625 HD21 ' HB3' ' A' ' 63' ' ' GLU . 71.5 mt -67.54 -21.41 65.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.801 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -78.03 -59.29 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -53.59 -34.8 59.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.748 0.308 . . . . 0.0 111.777 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.02 -24.78 35.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.823 -179.404 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.96 -58.0 8.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -46.4 68.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.876 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -55.05 -28.17 50.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.057 0.456 . . . . 0.0 110.789 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.981 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.33 -42.44 75.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.328 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -58.17 9.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.4 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -49.97 -32.8 15.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.444 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -66.46 -26.84 67.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.521 HG21 ' HG3' ' A' ' 8' ' ' GLU . 8.4 mt -74.81 -32.39 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.569 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.65 -33.18 74.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.413 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.42 -29.79 61.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.509 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.581 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.8 mt . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.971 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 . . . . . 0 CA--C 1.527 0.089 0 CA-C-O 120.699 0.285 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.74 -29.56 7.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.482 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -66.17 -31.0 71.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.029 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.2 tptp -66.33 -57.25 7.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.588 ' O ' HG23 ' A' ' 57' ' ' VAL . 44.8 t -55.49 -26.01 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.202 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.93 -36.58 84.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.57 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -73.79 -27.84 61.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.723 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -69.53 -28.69 66.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.981 HG22 HD21 ' A' ' 37' ' ' LEU . 10.2 t -82.76 -25.71 8.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.115 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.35 -28.38 59.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.597 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.08 -41.19 62.08 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.12 -26.17 47.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -71.54 -42.22 68.17 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.962 0.41 . . . . 0.0 110.735 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 65' ' ' LYS . 4.4 tt0 -74.26 -26.38 60.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.625 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -64.38 -59.2 4.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.405 -179.531 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.46 HD13 HG22 ' A' ' 18' ' ' VAL . 37.9 mt -51.29 -26.58 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.044 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 2.4 mptp? -52.9 -38.72 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.408 179.529 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.737 0.303 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -74.48 -30.4 61.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.496 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.01 -24.77 52.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -52.5 38.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.813 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.626 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.3 t -67.06 -29.21 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.351 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.06 75.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.78 -24.48 38.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 109.56 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.585 HD21 HD23 ' A' ' 60' ' ' LEU . 1.9 tt -64.99 -24.94 67.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.941 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.422 ' HG2' ' HG3' ' A' ' 19' ' ' LYS . 0.6 OUTLIER -77.38 -55.34 5.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.607 -179.122 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -46.8 -27.72 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.513 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -76.1 -40.5 52.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.313 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.465 HG22 HD13 ' A' ' 64' ' ' ILE . 13.1 t -78.19 -45.48 26.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.484 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG3' ' HG2' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -49.22 -29.91 6.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.495 -179.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.55 -13.23 37.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.472 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.507 HD22 HD13 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.978 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 N-CA-C 112.519 -0.232 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.591 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.96 -28.13 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 0.0 110.771 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.555 ' HA ' HD12 ' A' ' 30' ' ' LEU . 12.5 mt -67.78 -29.72 46.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.243 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -52.78 60.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.108 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -57.64 -30.39 65.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.923 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.979 HD23 ' HG ' ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.5 -21.86 61.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.306 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -78.09 -59.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.998 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.75 69.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.823 0.344 . . . . 0.0 111.809 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.576 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -71.55 -24.94 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.809 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.93 -57.96 8.99 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.631 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -47.07 66.87 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -28.09 49.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.096 0.474 . . . . 0.0 110.844 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.046 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -72.92 -39.0 66.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.431 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -53.08 62.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.451 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -27.99 68.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.384 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 6.5 tptm -67.09 -27.14 67.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.281 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.47 -33.59 23.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.881 0.372 . . . . 0.0 110.666 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.45 -31.46 72.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.21 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -77.11 -29.41 54.81 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.441 179.644 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.701 HD11 ' CG2' ' A' ' 53' ' ' VAL . 23.6 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.002 -179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 CA--C 1.527 0.062 0 CA-C-O 120.705 0.288 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.497 HG13 HD13 ' A' ' 44' ' ' LEU . 29.3 t -53.34 -27.89 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.396 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -28.54 67.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.044 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.25 -57.17 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.936 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.701 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.5 t -52.47 -27.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.481 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -63.27 -30.99 72.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.983 0.421 . . . . 0.0 110.687 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -80.97 -27.83 35.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.831 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -67.95 -28.72 67.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.046 HG22 HD21 ' A' ' 37' ' ' LEU . 21.2 t -81.05 -25.84 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.969 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.01 -28.42 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.332 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.25 -37.15 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.979 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.0 tt -76.08 -28.67 57.67 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.087 -0.245 . . . . 0.0 111.393 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.5 -56.13 12.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.917 0.389 . . . . 0.0 110.652 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -62.26 -26.79 68.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.841 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.854 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -61.82 -43.19 99.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.028 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.893 HG12 HD22 ' A' ' 30' ' ' LEU . 17.5 mt -65.72 -24.53 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.208 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.1 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.888 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.831 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.035 HD21 HG21 ' A' ' 57' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.878 0.371 . . . . 0.0 111.119 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.44 -33.11 66.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.381 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -19.6 56.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.534 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.12 -43.2 24.55 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.633 HG22 ' CG1' ' A' ' 57' ' ' VAL . 17.6 t -76.91 -29.39 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -63.07 -35.24 79.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.973 0.416 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.28 -26.76 35.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.606 0.717 . . . . 0.0 109.503 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' HG23 ' A' ' 18' ' ' VAL . 2.7 tt -63.15 -25.46 68.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.814 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.406 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.6 tt0 -76.86 -45.11 29.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.196 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.43 -29.03 22.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.143 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -45.95 30.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.593 HG22 HD13 ' A' ' 64' ' ' ILE . 2.9 t -70.87 -51.57 34.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.527 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -50.33 -31.01 13.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.364 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.2 -13.33 38.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.387 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.868 HD22 HD11 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.49 -62.03 2.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.868 HD11 HD22 ' A' ' 21' ' ' LEU . 10.6 mt -51.04 -29.15 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.952 -179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -60.04 -56.35 22.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -56.61 19.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.979 0.419 . . . . 0.0 111.365 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.936 HD13 HG12 ' A' ' 64' ' ' ILE . 37.5 mt -53.01 -21.02 3.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.467 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.9 -59.25 2.86 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -39.15 58.64 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.749 ' HD3' HD12 ' A' ' 60' ' ' LEU . 34.7 tttp -80.77 -24.67 38.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.282 -0.417 . . . . 0.0 112.12 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.3 -57.77 9.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.649 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -47.76 66.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.036 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.43 -28.19 42.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.064 0.459 . . . . 0.0 110.973 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.014 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.39 -41.71 72.66 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.313 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -58.98 -58.08 10.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.352 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.31 -28.02 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.41 -26.31 63.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.033 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -74.22 -32.55 32.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.969 0.414 . . . . 0.0 110.628 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.61 -33.98 76.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.515 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -73.72 -29.26 62.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.646 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.737 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.2 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.979 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 C--O 1.23 0.065 0 CA-C-O 120.701 0.286 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -48.91 -30.64 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.447 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -29.9 65.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.917 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -66.71 -57.19 7.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.878 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.737 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.6 t -56.57 -29.51 29.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.141 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.645 ' HA ' HD11 ' A' ' 7' ' ' LEU . 19.6 tt0 -62.25 -33.59 74.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.623 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -76.85 -28.01 55.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.786 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -67.58 -28.82 68.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.965 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.035 HG21 HD21 ' A' ' 7' ' ' LEU . 11.9 t -83.03 -25.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.998 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -74.11 -28.21 61.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.486 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.54 -41.45 54.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.749 HD12 ' HD3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -76.91 -25.73 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.505 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.45 -53.96 14.26 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.991 0.424 . . . . 0.0 110.628 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -64.39 -26.89 68.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.185 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.4 mm-40 -61.9 -59.08 5.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.258 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.936 HG12 HD13 ' A' ' 30' ' ' LEU . 33.5 mt -54.28 -25.45 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.667 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -53.0 -38.64 62.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.724 0.297 . . . . 0.0 111.438 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.6 mttp . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 120.864 0.364 . . . . 0.0 110.951 -179.8 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.754 0.312 . . . . 0.0 111.479 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -72.44 -31.34 65.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.596 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.25 -21.92 52.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.725 0.298 . . . . 0.0 111.378 -179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -54.98 9.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.235 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 57' ' ' VAL . 22.7 t -67.76 -29.21 44.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.419 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -59.5 -36.65 76.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.634 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.03 -23.99 38.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.6 0.714 . . . . 0.0 109.541 178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.567 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.24 -25.23 67.58 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.819 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HG3' ' HG3' ' A' ' 19' ' ' LYS . 26.9 tt0 -75.84 -46.02 32.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.012 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -53.17 -27.1 19.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.207 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -49.19 18.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.413 HG22 HD13 ' A' ' 64' ' ' ILE . 18.7 t -70.08 -55.2 15.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.376 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 6.2 mtpt -52.67 -24.53 8.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.492 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.92 -19.12 26.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.897 HD12 HG21 ' A' ' 27' ' ' ILE . 1.6 tm? . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.248 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -61.41 2.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.014 0.435 . . . . 0.0 110.922 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.897 HG21 HD12 ' A' ' 21' ' ' LEU . 2.0 mp -51.75 -29.46 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.911 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -56.18 25.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.49 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.422 . . . . 0.0 110.962 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.933 HD22 ' CG1' ' A' ' 64' ' ' ILE . 2.4 mt -69.2 -21.27 63.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.618 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -77.72 -59.19 2.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -54.1 32.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.352 . . . . 0.0 111.583 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 9.3 tttp -65.1 -25.07 67.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.784 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.5 -57.53 12.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.08 -52.34 43.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.46 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.8 tm-20 -49.49 -28.38 5.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 111.106 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.03 HD21 HG22 ' A' ' 57' ' ' VAL . 9.7 tp -71.87 -41.89 67.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.58 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -58.29 9.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.707 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -33.02 9.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.636 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 tttt -67.85 -27.19 66.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.165 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -76.0 -31.49 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.868 0.366 . . . . 0.0 110.752 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -69.69 -31.41 69.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.6 pt-20 -76.05 -29.6 58.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.529 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 50' ' ' VAL . 8.3 mt . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.018 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.768 0.318 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.617 HG23 HD13 ' A' ' 44' ' ' LEU . 14.7 p -54.35 -28.73 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.351 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -66.06 -32.84 74.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.153 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -69.69 -57.34 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.994 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.4 t -52.87 -25.81 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.432 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -65.87 -38.06 87.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.719 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -72.06 -27.78 62.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.84 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.84 -29.11 65.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.136 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.03 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.28 -25.85 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.116 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -75.31 -28.5 59.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.51 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -38.59 55.91 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.929 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.0 -25.34 47.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.616 0.246 . . . . 0.0 111.627 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -54.18 15.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.065 0.459 . . . . 0.0 110.466 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 -26.84 68.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.923 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.85 -51.19 70.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.166 -179.746 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.933 ' CG1' HD22 ' A' ' 30' ' ' LEU . 19.4 mt -62.03 -24.64 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.114 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -66.07 -31.87 73.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.969 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.6 mttm . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.894 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.659 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.789 0.328 . . . . 0.0 111.168 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -78.73 -39.98 34.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.323 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -19.97 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.381 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -53.76 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.192 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.579 HG22 ' CG1' ' A' ' 57' ' ' VAL . 31.6 t -64.31 -29.31 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.41 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -37.1 75.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.729 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 -23.93 41.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.511 0.672 . . . . 0.0 109.517 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.677 HD21 HD23 ' A' ' 60' ' ' LEU . 2.2 tt -65.22 -25.28 67.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.707 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.409 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 41.9 tt0 -79.09 -47.4 16.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -51.36 -30.64 19.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.899 0.381 . . . . 0.0 111.082 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.4 tttm -76.15 -38.04 57.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 14' ' ' LEU . 20.0 t -78.12 -56.26 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.399 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.7 mtpp -52.74 -24.62 9.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.243 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -18.75 26.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.98 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.629 HD11 HG12 ' A' ' 27' ' ' ILE . 1.2 pp . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.474 -0.25 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -37.27 72.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.864 0.364 . . . . 0.0 110.913 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.629 HG12 HD11 ' A' ' 21' ' ' LEU . 19.7 mt -63.41 -29.73 47.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.867 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.92 -56.18 17.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.628 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -27.09 67.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 63' ' ' GLU . 96.5 mt -76.83 -21.54 54.89 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.552 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -78.33 -59.35 2.82 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -53.34 -36.24 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 111.727 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.77 35.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.842 -179.265 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.8 -57.71 9.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -44.94 72.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.885 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 52.9 tt0 -55.34 -28.04 51.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.161 0.505 . . . . 0.0 110.776 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 6.1 tp -70.97 -42.2 70.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.337 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -57.96 -58.19 9.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.537 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 7.1 pttt -51.69 -28.36 14.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -70.74 -26.9 63.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.013 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.546 ' HA ' HD12 ' A' ' 44' ' ' LEU . 6.9 mt -77.73 -29.56 16.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.867 0.365 . . . . 0.0 110.749 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -38.98 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.423 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.434 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.7 pt-20 -68.17 -35.21 77.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.347 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.858 HD11 HG21 ' A' ' 53' ' ' VAL . 7.0 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.024 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.598 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 4.8 tt0 . . . . . 0 C--O 1.227 -0.083 0 CA-C-O 120.62 0.247 . . . . 0.0 111.533 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -64.78 -14.69 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.706 0.288 . . . . 0.0 111.234 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -52.92 11.43 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.598 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -54.81 -57.2 12.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 44' ' ' LEU . 16.5 t -55.66 -31.31 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.806 0.336 . . . . 0.0 111.246 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.659 ' HG2' HD11 ' A' ' 7' ' ' LEU . 2.1 tm-20 -61.95 -32.7 73.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -77.37 -27.74 52.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.841 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.02 -29.94 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 14.5 t -83.31 -25.56 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.179 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -28.18 61.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.376 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -37.83 59.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.757 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.677 HD23 HD21 ' A' ' 14' ' ' LEU . 1.1 tt -78.09 -25.7 47.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.759 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.29 -55.53 8.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 110.496 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.28 -26.89 68.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.919 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.865 ' HB3' HD21 ' A' ' 30' ' ' LEU . 5.1 mt-10 -62.58 -49.35 75.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.464 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.793 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -58.21 -27.75 33.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.075 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -67.35 -30.35 70.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.898 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.959 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.726 0.298 . . . . 0.0 111.596 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -74.53 -33.43 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.548 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.94 -19.72 57.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.21 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -42.79 47.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.143 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.9 t -74.12 -29.42 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.379 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -62.08 -36.02 80.41 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.347 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.22 -24.49 37.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.463 0.649 . . . . 0.0 109.54 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.55 HD21 HD23 ' A' ' 60' ' ' LEU . 1.4 tt -65.74 -25.24 67.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.745 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 35.6 tt0 -74.17 -40.31 62.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.167 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -53.63 -28.61 33.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.196 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 tptt -76.06 -43.8 42.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.754 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.4 t -73.97 -52.56 20.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.373 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.3 mttm -49.12 -31.71 8.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.321 . . . . 0.0 111.577 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.14 -12.28 61.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.754 HD12 ' O ' ' A' ' 18' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.297 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.26 -27.8 4.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.72 0.295 . . . . 0.0 111.229 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.697 HG21 ' HG ' ' A' ' 21' ' ' LEU . 55.6 mt -65.01 -29.95 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.441 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -62.22 -56.06 22.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -58.84 -27.0 64.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.894 0.378 . . . . 0.0 110.836 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.985 HD21 ' HB3' ' A' ' 63' ' ' GLU . 4.9 mt -73.71 -23.4 59.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.292 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -78.32 -59.43 2.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -36.98 45.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.671 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.93 35.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.022 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.43 -57.85 8.1 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -178.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -43.51 73.8 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.29 -28.2 64.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.029 0.442 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.139 HD21 HG22 ' A' ' 57' ' ' VAL . 6.4 tp -69.13 -48.3 62.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.458 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -58.25 8.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.532 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -29.03 30.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.399 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 28.4 tttm -70.04 -26.25 63.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.2 mt -76.76 -32.34 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 0.0 110.712 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -69.0 -32.57 72.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.443 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.479 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.32 -29.97 60.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.518 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.73 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.2 mt . . . . . 0 C--N 1.327 -0.391 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.963 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.632 0.253 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 22.1 t -56.0 -21.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.609 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -75.61 -25.95 57.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -78.01 -57.31 3.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.108 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.73 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.8 t -57.45 -29.8 34.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.369 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -38.57 90.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 110.649 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.69 -27.68 63.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.862 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.59 -29.28 66.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.307 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.139 HG22 HD21 ' A' ' 37' ' ' LEU . 15.4 t -83.21 -25.77 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.919 0.39 . . . . 0.0 111.187 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.84 -28.31 60.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.275 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmt? -75.16 -41.01 59.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.76 -179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.925 ' HG ' HD23 ' A' ' 30' ' ' LEU . 2.1 tt -73.59 -27.64 61.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.642 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.58 -56.04 11.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.885 0.374 . . . . 0.0 110.789 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 65' ' ' LYS . 6.3 tt0 -61.11 -26.93 68.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.985 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.91 -49.38 75.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.389 -179.485 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.581 ' CG1' HD22 ' A' ' 30' ' ' LEU . 16.8 mt -63.82 -24.46 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.755 0.312 . . . . 0.0 111.313 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 49.7 mmtt -55.99 -37.66 69.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.131 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.699 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.771 0.319 . . . . 0.0 111.007 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -73.33 -33.35 65.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.078 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -77.2 -20.01 55.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.302 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -45.63 65.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.255 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.489 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.9 t -75.91 -29.42 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.475 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -35.86 81.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.979 0.419 . . . . 0.0 110.173 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -24.06 37.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.515 0.674 . . . . 0.0 109.467 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.613 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER -66.05 -25.15 66.92 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.915 179.426 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.85 -56.13 4.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.365 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -47.04 -29.52 2.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.366 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -76.04 -39.53 55.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.003 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 14' ' ' LEU . 25.0 t -78.09 -51.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.326 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -51.21 -29.87 15.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.408 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.93 -11.78 35.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.327 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.868 0.366 . . . . 0.0 110.937 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.508 -0.237 . . . . 0.0 112.508 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.524 ' O ' HD12 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -56.88 -27.77 60.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 111.02 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -70.14 -29.66 40.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.282 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -56.09 22.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.75 68.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.91 HD23 ' HG ' ' A' ' 60' ' ' LEU . 9.3 mt -71.16 -21.62 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.612 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -78.53 -58.97 2.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.08 -59.04 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.641 ' NZ ' HD12 ' A' ' 60' ' ' LEU . 4.1 ttpm? -61.22 -25.06 66.8 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.936 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.21 -57.63 11.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.34 -55.41 16.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.511 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 33.7 tt0 -48.47 -28.51 3.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.983 0.421 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.1 HD21 HG22 ' A' ' 57' ' ' VAL . 10.9 tp -70.32 -42.63 71.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.805 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -58.49 6.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 111.739 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.23 -27.94 10.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.513 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.43 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 7.9 ttpt -70.73 -28.22 64.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.093 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.14 -32.76 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.659 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.09 -33.38 74.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.344 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.4 pt-20 -73.98 -29.73 62.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 HG22 ' A' ' 50' ' ' VAL . 9.8 mt . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.009 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.425 ' CD ' HD21 ' A' ' 44' ' ' LEU . 3.4 tt0 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.779 0.324 . . . . 0.0 111.002 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.6 HG22 HD13 ' A' ' 44' ' ' LEU . 21.7 t -59.28 -19.66 16.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.519 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -70.65 -35.06 72.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -73.56 -57.15 4.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.545 ' O ' HG23 ' A' ' 57' ' ' VAL . 38.7 t -53.14 -25.96 10.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.309 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -35.83 82.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.609 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -74.54 -27.88 60.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.73 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -70.12 -28.73 65.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.1 HG22 HD21 ' A' ' 37' ' ' LEU . 15.9 t -83.1 -25.83 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -75.27 -28.42 59.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.533 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -76.06 -38.56 56.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.91 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.18 -25.09 47.0 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.598 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -54.18 15.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.001 0.429 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -64.76 -26.83 68.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.651 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.903 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -58.78 -56.2 25.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.9 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.699 ' CG1' HD22 ' A' ' 30' ' ' LEU . 23.5 mt -59.15 -24.5 27.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.187 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -31.54 72.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.88 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 mttm . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 179.972 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.495 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HG3' HG21 ' A' ' 41' ' ' ILE . 53.2 mt-10 -75.12 -32.54 61.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.243 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -77.19 -20.68 55.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.245 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -68.86 -51.0 45.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.016 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.682 HG22 ' CG1' ' A' ' 57' ' ' VAL . 14.7 t -71.57 -29.14 33.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.492 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.9 ttpt -60.86 -36.38 79.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.441 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.1 -24.67 37.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.409 0.623 . . . . 0.0 109.559 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.49 -25.4 67.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.892 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.7 tt0 -77.71 -47.76 18.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.25 -29.57 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.319 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -76.14 -40.01 53.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.494 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 10.1 t -78.01 -59.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.997 0.427 . . . . 0.0 111.235 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -51.49 -22.82 3.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.99 -18.28 29.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.379 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.834 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.911 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.569 -0.212 . . . . 0.0 112.569 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -54.67 -62.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.111 0.481 . . . . 0.0 110.842 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.834 HG21 HD11 ' A' ' 21' ' ' LEU . 4.9 mt -55.42 -29.55 24.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.803 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -56.24 20.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.666 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.16 -41.12 87.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.991 0.424 . . . . 0.0 110.853 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.932 HD23 ' HG ' ' A' ' 60' ' ' LEU . 2.9 mt -59.41 -21.13 59.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.702 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.4 -59.0 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -59.05 4.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.886 0.374 . . . . 0.0 111.691 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HZ3' HD12 ' A' ' 60' ' ' LEU . 1.3 ttpt -61.21 -24.86 66.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.845 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.38 -57.5 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.34 -54.63 16.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -178.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.52 -28.3 3.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.02 0.438 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.041 HD21 HG22 ' A' ' 57' ' ' VAL . 9.0 tp -69.13 -41.48 77.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.468 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -58.26 8.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.44 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -52.02 -27.93 15.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.409 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.25 -29.07 67.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.047 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.402 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.7 mt -75.2 -32.59 26.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 0.0 110.602 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -31.3 71.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.394 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.1 OUTLIER -76.37 -29.93 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.473 179.673 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.652 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.4 mt . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.976 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.748 0.308 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.617 HG22 HD22 ' A' ' 44' ' ' LEU . 21.8 t -56.01 -26.3 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -62.93 -32.15 73.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.054 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.17 -57.19 13.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.85 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.652 ' CG2' HD11 ' A' ' 44' ' ' LEU . 22.9 t -57.46 -25.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.209 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.17 -32.92 74.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -27.85 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -70.08 -28.72 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.041 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.22 -25.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.062 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -28.63 59.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.587 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.24 -37.77 57.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.932 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.4 tt -78.04 -25.24 47.71 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.581 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -55.44 10.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.051 0.453 . . . . 0.0 110.268 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -63.56 -26.88 68.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.813 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.93 ' HB3' HD21 ' A' ' 30' ' ' LEU . 11.9 mm-40 -60.11 -50.99 71.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.976 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.901 ' CG1' HD22 ' A' ' 30' ' ' LEU . 22.1 mt -61.74 -24.18 33.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.17 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -30.66 71.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.023 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 28.7 mttt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.908 179.86 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.52 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.831 0.348 . . . . 0.0 111.224 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.56 -31.21 53.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.549 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -77.15 -22.4 52.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.714 0.292 . . . . 0.0 111.254 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -54.36 8.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 HG13 ' A' ' 57' ' ' VAL . 25.1 t -65.79 -29.41 46.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.492 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -59.03 -36.78 75.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.68 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.28 -23.97 40.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.488 0.661 . . . . 0.0 109.336 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.07 -25.25 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.82 179.316 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 54.4 tt0 -78.34 -41.98 31.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.212 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -55.14 -30.98 60.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.031 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.469 ' HD3' HG21 ' A' ' 64' ' ' ILE . 10.8 tttm -76.08 -42.84 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.25 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' LEU . 2.9 t -73.43 -52.55 21.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.475 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.6 mttt -50.01 -31.07 11.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.22 -10.89 36.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.36 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.936 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.257 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.95 -44.01 86.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.995 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.506 HG12 HD13 ' A' ' 21' ' ' LEU . 7.5 mt -64.94 -29.57 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.58 -56.35 23.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.708 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.68 -47.02 85.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.933 0.397 . . . . 0.0 111.182 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.889 HD13 HG12 ' A' ' 64' ' ' ILE . 76.4 mt -57.87 -21.06 41.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.86 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -74.51 -59.1 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -50.9 -46.81 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.76 -24.66 60.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.095 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.07 -57.78 9.5 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -70.29 -52.45 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.767 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.484 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.2 tm-20 -50.18 -28.2 7.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.159 0.504 . . . . 0.0 110.937 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.048 HD21 HG22 ' A' ' 57' ' ' VAL . 8.5 tp -69.86 -43.68 71.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.224 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.81 -58.29 9.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.314 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -52.62 -27.9 19.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.331 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 -25.78 63.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.216 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.2 mt -79.35 -32.81 15.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 111.042 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -66.65 -38.73 87.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.738 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -70.33 -37.54 74.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.826 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.2 mt . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.049 -179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.728 0.299 . . . . 0.0 111.058 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -49.06 -29.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.519 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -71.98 -29.44 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -69.12 -57.34 5.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.069 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.826 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.6 t -56.85 -29.55 30.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.08 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -61.38 -40.41 94.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.49 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.93 -27.82 65.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.682 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -68.52 -28.66 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.006 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.048 HG22 HD21 ' A' ' 37' ' ' LEU . 18.5 t -82.76 -25.86 8.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.078 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt -75.12 -28.18 60.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.513 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -75.65 -38.39 58.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.672 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.22 -25.77 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.401 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -70.98 -51.35 26.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.017 0.437 . . . . 0.0 110.738 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -67.64 -26.65 66.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.217 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.723 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.74 -59.06 5.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.434 -179.422 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.889 HG12 HD13 ' A' ' 30' ' ' LEU . 35.3 mt -50.31 -28.39 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.536 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -27.48 65.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.733 0.301 . . . . 0.0 110.895 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.672 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.514 HD11 ' HA ' ' A' ' 54' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.821 0.343 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HG3' HG21 ' A' ' 41' ' ' ILE . 62.6 mt-10 -67.62 -32.93 73.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -77.27 -20.1 55.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.734 0.302 . . . . 0.0 111.312 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -43.56 58.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.58 HG22 HG13 ' A' ' 57' ' ' VAL . 23.2 t -75.41 -29.3 21.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.475 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -62.75 -35.83 81.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 0.0 110.182 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 -23.86 37.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.549 0.69 . . . . 0.0 109.499 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.516 HD21 HD23 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -66.38 -25.49 66.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.875 179.439 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 25.1 tt0 -74.93 -51.54 13.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.207 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -51.3 -27.33 9.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.128 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -76.05 -40.94 52.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.832 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.53 HG22 HD13 ' A' ' 64' ' ' ILE . 19.1 t -78.08 -52.6 15.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.068 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.4 mtpp -55.55 -19.92 11.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.33 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.75 -17.57 26.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.43 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.551 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.5 pp . . . . . 0 C--N 1.331 -0.205 0 CA-C-O 120.86 0.362 . . . . 0.0 110.808 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.393 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -27.62 61.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.745 0.307 . . . . 0.0 111.063 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.422 HD13 ' CD1' ' A' ' 21' ' ' LEU . 58.8 mt -66.04 -29.73 47.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.464 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.21 -56.14 12.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.484 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -59.16 -26.87 65.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.78 0.324 . . . . 0.0 111.369 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.646 HD11 ' OE1' ' A' ' 63' ' ' GLU . 92.1 mt -79.56 -21.61 44.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.72 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -76.74 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.67 -51.55 55.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 111.742 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -66.74 -25.12 66.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.844 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.09 -57.62 11.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.06 -55.3 14.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 112.057 -178.672 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.23 -28.44 3.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.061 0.458 . . . . 0.0 111.336 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.078 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.07 -41.7 77.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.486 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -58.17 8.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.628 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 2.9 ptmt -52.1 -27.96 15.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.47 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 22.1 tttt -70.58 -25.56 63.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.502 HG21 ' HG3' ' A' ' 8' ' ' GLU . 6.9 mt -77.11 -40.79 30.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 111.089 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 1.9 pt-20 -65.89 -28.89 69.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.812 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 5.5 pt-20 -77.68 -30.92 52.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.375 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.64 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.0 mt . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.935 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.408 ' HG2' HD21 ' A' ' 44' ' ' LEU . 11.8 tt0 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.778 0.323 . . . . 0.0 110.963 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.6 t -56.11 -22.79 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.41 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.95 -29.89 55.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.897 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.03 -57.27 6.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.95 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.64 ' CG2' HD11 ' A' ' 44' ' ' LEU . 23.8 t -60.19 -29.87 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' HD11 ' A' ' 7' ' ' LEU . 7.2 tp10 -62.51 -33.27 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.645 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -27.89 53.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.794 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -67.9 -29.21 68.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.078 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.26 -25.61 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.032 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -73.44 -28.15 61.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.35 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.585 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -74.07 -24.98 59.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.054 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -56.0 8.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.937 0.399 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -61.35 -26.99 68.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.153 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.646 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.3 tm-20 -61.99 -58.93 6.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.103 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.551 HG12 HD13 ' A' ' 30' ' ' LEU . 31.5 mt -52.89 -25.2 8.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.269 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.5 mttp . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 179.93 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.699 0.285 . . . . 0.0 111.35 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HG3' HG21 ' A' ' 41' ' ' ILE . 39.2 mt-10 -74.39 -35.8 63.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.694 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.61 -19.7 60.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.704 0.288 . . . . 0.0 111.523 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -73.07 -51.04 19.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.202 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.608 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.5 t -68.4 -29.21 43.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.648 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -36.71 77.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.99 -23.92 38.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.532 0.682 . . . . 0.0 109.508 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.587 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.31 -25.14 67.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.834 179.271 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' HG3' ' HG3' ' A' ' 19' ' ' LYS . 26.0 tt0 -75.1 -44.95 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.54 -26.12 12.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.99 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -76.08 -54.45 6.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.4 t -65.0 -53.45 41.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.261 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 3.1 mtpp -53.58 -26.55 22.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.22 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.69 -10.91 38.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.46 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.45 -0.451 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.626 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -27.66 61.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.739 0.304 . . . . 0.0 111.07 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.5 mt -73.94 -29.61 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.293 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -65.05 -56.14 14.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.599 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.46 -35.14 76.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 0.0 111.202 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.751 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.0 mt -69.97 -21.42 63.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.659 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -76.64 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.628 0.251 . . . . 0.0 111.577 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.34 -37.08 62.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.581 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.446 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.48 -24.84 45.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.746 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -57.95 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -40.5 90.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.079 -178.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.12 -28.21 69.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 111.081 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.935 HD11 HG22 ' A' ' 57' ' ' VAL . 0.1 OUTLIER -70.18 -55.1 10.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.673 -179.107 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.96 -58.11 6.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 111.596 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.0 -27.92 8.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.413 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HE3' HG22 ' A' ' 53' ' ' VAL . 7.0 ttpt -71.09 -28.46 64.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.999 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.495 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.9 mt -75.07 -31.35 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.636 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.92 -34.45 75.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -72.59 -29.76 63.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.461 179.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.635 HD13 HG23 ' A' ' 50' ' ' VAL . 5.6 mt . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.945 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.832 0.348 . . . . 0.0 110.979 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.635 HG23 HD13 ' A' ' 44' ' ' LEU . 13.6 p -52.55 -30.65 14.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.33 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -60.57 -27.14 67.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.139 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -68.52 -57.25 6.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.063 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.626 ' O ' HG23 ' A' ' 57' ' ' VAL . 23.9 t -53.68 -26.08 12.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.222 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' HD11 ' A' ' 7' ' ' LEU . 6.7 mt-10 -65.2 -32.6 74.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.482 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.56 -27.94 51.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.705 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -68.62 -28.85 67.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.574 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.935 HG22 HD11 ' A' ' 37' ' ' LEU . 2.5 t -83.09 -25.52 8.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.894 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -28.18 61.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.527 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -75.27 -43.32 51.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.751 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.91 -25.15 58.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -54.1 12.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -62.87 -27.02 69.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.108 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.621 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.7 -59.0 5.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.479 HG12 HD13 ' A' ' 30' ' ' LEU . 29.9 mt -55.16 -26.15 17.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -61.72 -34.23 75.42 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.879 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.8 -179.988 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.528 0.102 0 CA-C-O 120.734 0.302 . . . . 0.0 111.272 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.467 ' HG2' HG21 ' A' ' 41' ' ' ILE . 29.7 mt-10 -79.01 -39.71 33.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -19.75 62.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.4 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -53.9 15.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.42 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.605 HG22 HG13 ' A' ' 57' ' ' VAL . 19.6 t -66.54 -29.3 46.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.754 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -59.48 -36.71 76.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.628 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.42 -23.83 40.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.576 0.703 . . . . 0.0 109.393 178.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.41 -25.26 67.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.912 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 42.0 tt0 -77.33 -52.89 8.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.241 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -49.99 -27.95 6.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.894 0.378 . . . . 0.0 111.197 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -76.09 -42.74 46.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.623 HG22 HD13 ' A' ' 64' ' ' ILE . 14.8 t -76.41 -48.44 27.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.2 OUTLIER -50.02 -32.38 15.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.273 -179.58 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.1 -10.82 40.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.45 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.418 HD22 ' CD1' ' A' ' 27' ' ' ILE . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.895 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.299 0 N-CA-C 112.621 -0.192 . . . . 0.0 112.621 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -27.72 62.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.76 0.314 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.418 ' CD1' HD22 ' A' ' 21' ' ' LEU . 59.2 mt -67.65 -29.72 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.368 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.45 -56.18 12.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.659 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.63 -27.56 66.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.297 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.585 ' O ' HD11 ' A' ' 60' ' ' LEU . 84.5 mt -78.87 -21.58 47.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.749 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.0 -58.66 3.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.715 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.35 -43.28 61.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.758 0.313 . . . . 0.0 111.824 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.86 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.015 -179.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.25 -57.78 9.32 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.733 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -46.54 68.72 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.22 -28.07 38.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.075 0.464 . . . . 0.0 110.855 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.98 HD21 HG22 ' A' ' 57' ' ' VAL . 7.8 tp -70.88 -42.74 69.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.529 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.3 9.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.797 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -51.34 -27.76 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.661 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -25.97 60.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.296 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.467 HG21 ' HG2' ' A' ' 8' ' ' GLU . 10.0 mt -71.26 -57.03 8.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.8 0.333 . . . . 0.0 110.681 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -23.93 64.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.128 0.49 . . . . 0.0 110.038 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -86.33 -12.98 47.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.206 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.527 HD11 ' CG2' ' A' ' 53' ' ' VAL . 2.2 mt . . . . . 0 C--N 1.331 -0.21 0 CA-C-O 120.914 0.388 . . . . 0.0 110.902 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.442 ' HG2' HD21 ' A' ' 44' ' ' LEU . 22.2 tt0 . . . . . 0 CA--C 1.527 0.087 0 CA-C-O 120.761 0.315 . . . . 0.0 111.163 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.462 ' HA ' HD13 ' A' ' 44' ' ' LEU . 27.1 t -55.34 -24.65 15.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -28.77 58.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.932 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -57.41 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.87 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 57' ' ' VAL . 24.7 t -62.59 -26.02 39.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -67.09 -34.66 78.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.615 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.56 -27.96 58.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.798 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.57 -28.94 65.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.009 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.98 HG22 HD21 ' A' ' 37' ' ' LEU . 21.3 t -83.13 -25.84 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.168 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -28.48 59.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.655 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.31 -42.01 46.67 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.646 HD23 HD21 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -75.48 -25.0 57.0 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.261 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.06 -55.35 9.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.984 0.421 . . . . 0.0 110.552 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.64 -27.0 68.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.242 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.21 -59.11 5.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.283 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.623 HD13 HG22 ' A' ' 18' ' ' VAL . 30.3 mt -54.42 -26.41 15.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.211 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -33.35 75.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.1 mmtt . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 179.992 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.144 0 CA-C-O 120.706 0.289 . . . . 0.0 111.358 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -83.09 -35.55 25.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.355 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -73.13 -19.72 61.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -55.05 8.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.991 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.507 HG22 HG13 ' A' ' 57' ' ' VAL . 21.3 t -63.89 -29.37 47.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.277 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -36.97 75.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -23.98 41.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.461 0.648 . . . . 0.0 109.635 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.39 -25.45 67.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.721 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.426 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 36.3 tt0 -77.0 -40.57 46.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.246 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -54.29 -27.94 38.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 64' ' ' ILE . 2.9 ttpm? -76.21 -47.67 23.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.677 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.6 t -70.55 -53.31 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.445 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.0 mttt -50.05 -30.82 11.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.478 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.21 -10.99 60.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.541 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.821 HD13 ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.456 -179.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.253 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.8 -43.53 65.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.048 179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.786 HG21 ' HG ' ' A' ' 21' ' ' LEU . 3.6 mt -59.7 -29.41 42.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.754 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -56.27 24.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -58.25 -38.59 77.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.453 . . . . 0.0 111.187 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.788 HD13 HG12 ' A' ' 64' ' ' ILE . 16.2 mt -66.15 -21.09 66.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.657 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -75.45 -55.93 5.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -53.83 -51.45 63.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.735 0.302 . . . . 0.0 111.606 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -68.15 -25.05 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.931 -179.251 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.86 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.04 -54.27 19.61 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.2 tt0 -48.53 -28.37 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.062 0.458 . . . . 0.0 111.19 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.013 HD21 HG22 ' A' ' 57' ' ' VAL . 3.2 tp -68.87 -41.14 78.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.259 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -61.7 -58.27 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.15 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -27.98 25.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 27.3 tttt -68.9 -27.43 65.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.967 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 HG11 ' A' ' 53' ' ' VAL . 8.9 mt -73.88 -31.06 29.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.903 0.382 . . . . 0.0 110.653 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -69.56 -34.6 74.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.423 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -72.53 -29.1 63.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.6 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.4 mt . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.994 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG2' HD21 ' A' ' 44' ' ' LEU . 27.1 tt0 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.695 0.283 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.22 -16.92 17.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.565 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.19 -33.21 65.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.796 0.332 . . . . 0.0 111.098 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -65.99 -57.28 8.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.539 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.5 t -59.89 -25.73 33.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.216 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.32 -37.28 85.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.72 -27.74 62.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -70.67 -29.7 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.031 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.013 HG22 HD21 ' A' ' 37' ' ' LEU . 19.8 t -83.33 -25.87 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.204 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -75.34 -28.42 59.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.667 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -41.28 57.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.16 -26.16 47.61 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -178.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.487 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.53 -49.38 48.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.088 0.47 . . . . 0.0 110.728 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.11 -26.82 65.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.4 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.623 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -63.41 -59.1 5.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.29 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.788 HG12 HD13 ' A' ' 30' ' ' LEU . 39.6 mt -50.58 -28.41 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.387 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -64.43 -31.49 72.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.628 179.882 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.743 0.306 . . . . 0.0 111.301 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -82.24 -37.99 25.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.58 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.05 -19.87 62.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.782 0.325 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -52.84 10.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.896 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.422 HG22 HG13 ' A' ' 57' ' ' VAL . 18.1 t -61.71 -29.19 45.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.426 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -37.26 73.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.774 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 -24.34 40.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.477 0.656 . . . . 0.0 109.611 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.685 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.2 tt -65.36 -25.18 67.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.761 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 56.8 tt0 -79.09 -42.72 25.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.353 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -53.7 -27.54 28.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.105 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 tppt? -76.16 -48.36 20.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.249 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.571 HG22 HD13 ' A' ' 64' ' ' ILE . 3.2 t -70.78 -49.6 49.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.618 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 10.2 mttt -51.24 -31.73 21.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.798 0.333 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.32 -10.85 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.419 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.613 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.664 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.583 -0.207 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.34 -27.54 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.798 0.333 . . . . 0.0 111.023 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.613 HG12 HD13 ' A' ' 21' ' ' LEU . 22.3 mt -73.55 -29.61 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.467 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -56.18 18.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.684 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.91 -42.82 94.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.392 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.58 HD13 HG12 ' A' ' 64' ' ' ILE . 53.7 mt -63.63 -21.41 66.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.811 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -75.81 -59.08 2.91 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.2 tttp -50.59 -56.32 12.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.768 0.318 . . . . 0.0 111.753 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.74 -24.99 67.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.767 -179.422 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.04 -57.88 10.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.518 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.14 -56.44 9.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.072 -178.498 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.518 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -47.94 -28.36 2.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.388 . . . . 0.0 111.412 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.059 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -67.54 -39.88 85.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.344 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -58.2 5.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.469 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -52.89 -27.68 19.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.341 -179.743 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.409 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 10.6 tttt -68.5 -28.73 67.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 mt -73.63 -31.0 30.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.657 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.19 -33.93 74.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.466 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -73.24 -29.2 62.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.62 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.7 mt . . . . . 0 C--N 1.328 -0.341 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.901 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.487 ' HB3' HD21 ' A' ' 44' ' ' LEU . 0.8 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.706 0.289 . . . . 0.0 111.118 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -53.37 -24.69 9.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.439 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -72.43 -36.5 68.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.89 0.376 . . . . 0.0 110.973 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -62.96 -57.23 11.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.3 t -57.93 -28.05 32.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.372 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.46 -36.24 83.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 110.728 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.34 -27.73 60.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.969 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.27 -29.26 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.377 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.059 HG22 HD21 ' A' ' 37' ' ' LEU . 17.5 t -83.27 -26.67 7.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.347 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.47 -28.38 59.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.691 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -76.79 -40.77 47.02 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.51 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.08 -25.81 47.84 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.978 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 -52.41 17.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.878 0.371 . . . . 0.0 110.55 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.46 -26.97 68.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.085 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.48 -59.13 5.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.58 HG12 HD13 ' A' ' 30' ' ' LEU . 35.2 mt -55.01 -25.69 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.254 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.02 -31.85 61.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.369 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.236 -179.635 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.421 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.146 0 CA-C-O 120.736 0.303 . . . . 0.0 111.065 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' CG2' ' A' ' 41' ' ' ILE . 53.7 mt-10 -75.5 -37.0 60.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -19.95 60.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.432 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.22 -48.81 40.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.006 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.444 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.6 t -68.64 -29.3 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.514 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.0 -36.52 77.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.458 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -23.86 40.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.639 0.733 . . . . 0.0 109.407 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.749 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.4 OUTLIER -65.71 -25.22 67.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.982 179.38 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -75.87 -55.33 5.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.398 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -47.14 -30.91 3.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -37.94 57.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.769 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.749 HG23 ' O ' ' A' ' 14' ' ' LEU . 21.4 t -78.15 -48.66 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.303 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -31.55 17.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.335 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.16 -10.98 39.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.542 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.455 HD22 ' CD1' ' A' ' 27' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.841 0.353 . . . . 0.0 110.909 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -27.81 69.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.023 -179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.455 ' CD1' HD22 ' A' ' 21' ' ' LEU . 25.6 mt -65.42 -29.76 48.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.501 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -64.66 -56.25 15.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.661 -179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.06 -26.89 66.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.727 0.298 . . . . 0.0 111.226 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 87.9 mt -77.21 -21.77 53.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.517 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -59.44 2.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.688 0.28 . . . . 0.0 111.724 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.03 -37.82 61.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.786 0.327 . . . . 0.0 111.722 -179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.77 -24.87 41.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.831 -179.409 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.7 -57.96 8.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.794 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.04 74.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.552 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -27.98 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.189 0.519 . . . . 0.0 110.561 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.115 HD21 HG22 ' A' ' 57' ' ' VAL . 12.5 tp -76.55 -38.9 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.536 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -28.48 69.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.107 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -79.05 -27.63 43.13 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -73.13 -34.18 65.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.49 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.41 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 12.3 mt -67.37 -57.7 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.721 0.296 . . . . 0.0 110.701 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -58.28 -23.97 57.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.195 0.521 . . . . 0.0 110.044 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -84.81 -12.88 52.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.162 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.2 mt . . . . . 0 C--O 1.231 0.128 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.939 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.748 0.309 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -56.69 -22.19 14.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.417 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -72.99 -29.73 63.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.1 -57.29 6.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.867 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.1 t -57.91 -28.1 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 -37.78 88.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.81 -27.99 63.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.728 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.57 -30.28 69.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.115 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.03 -25.55 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.164 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.7 -27.92 61.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.458 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.407 ' CE ' ' HG3' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -75.24 -40.94 58.52 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.581 HD23 HD21 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -76.89 -25.09 52.63 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.032 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -53.74 14.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.639 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -64.75 -26.89 68.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.524 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.26 -59.09 5.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.699 HD13 HG22 ' A' ' 18' ' ' VAL . 28.1 mt -56.42 -25.41 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.231 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.36 75.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.922 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 39.9 mtpt . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.738 179.951 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.497 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.739 0.304 . . . . 0.0 111.334 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.416 ' HG2' HG21 ' A' ' 41' ' ' ILE . 30.7 mt-10 -80.27 -37.69 32.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.504 -179.439 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -19.74 61.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.348 -179.799 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -48.96 25.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.447 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.635 HG22 HG13 ' A' ' 57' ' ' VAL . 17.8 t -68.21 -29.2 43.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.709 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -36.49 77.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.606 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.05 -24.0 38.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.445 0.64 . . . . 0.0 109.768 178.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.704 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.5 tt -66.37 -25.08 66.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.753 179.497 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.417 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 27.6 tt0 -77.27 -46.46 23.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -179.626 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -49.6 -27.86 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -76.21 -48.69 19.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.388 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.7 t -70.0 -51.46 39.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.7 mttt -51.0 -31.17 17.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.798 0.333 . . . . 0.0 111.129 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.62 -10.91 47.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.472 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.842 HD22 HD13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.362 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 -179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.509 -0.236 . . . . 0.0 112.509 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.8 -27.74 63.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.725 0.298 . . . . 0.0 110.955 179.899 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.842 HD13 HD22 ' A' ' 21' ' ' LEU . 29.4 mt -67.63 -29.79 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.711 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -43.65 71.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.93 -179.179 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -70.14 -26.85 64.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.685 0.279 . . . . 0.0 111.432 -179.419 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 72.8 mt -81.06 -21.62 39.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.494 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.74 -59.15 2.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.343 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -52.64 -48.23 66.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.64 -179.539 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.22 -25.2 65.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.736 -179.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.25 -57.87 9.83 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.001 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.87 -55.06 18.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.904 -178.596 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.7 tt0 -49.33 -28.47 4.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 5.0 tp -67.96 -38.56 82.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.281 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -66.48 -58.36 5.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.259 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.439 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 3.1 pttt -51.61 -27.51 11.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.202 -179.871 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.484 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 2.7 tptm -70.8 -25.81 63.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.0 mt -75.71 -42.1 40.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.08 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.26 -30.72 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.608 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 2.9 pt-20 -75.62 -30.66 59.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.095 0.474 . . . . 0.0 110.513 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.3 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.791 179.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.606 ' HB3' HD21 ' A' ' 44' ' ' LEU . 11.7 tt0 . . . . . 0 CA--C 1.529 0.15 0 CA-C-O 120.604 0.24 . . . . 0.0 111.334 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.3 t -52.5 -25.11 7.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.302 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.55 -28.6 65.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -73.29 -57.18 4.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.4 t -55.51 -26.3 19.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.479 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -65.41 -38.05 88.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.99 0.424 . . . . 0.0 110.591 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -72.32 -27.61 62.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.893 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -71.41 -28.9 64.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.493 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.32 -27.7 7.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.283 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -75.61 -28.42 58.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.653 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -76.29 -40.18 52.33 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -178.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.07 -26.16 48.05 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -71.05 -49.47 44.4 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.934 0.397 . . . . 0.0 110.637 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.72 -26.9 65.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.238 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.506 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -62.36 -59.26 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.095 -179.631 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.58 HG12 HD13 ' A' ' 30' ' ' LEU . 39.1 mt -51.31 -25.86 4.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -33.99 75.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.818 179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.401 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.782 0.325 . . . . 0.0 111.195 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.511 ' HG3' HG21 ' A' ' 41' ' ' ILE . 45.9 mt-10 -76.76 -31.38 57.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.601 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -77.05 -22.34 53.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.731 0.3 . . . . 0.0 111.307 -179.776 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.28 -55.04 8.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.01 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.587 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -65.4 -29.38 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.508 -179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.45 -37.18 74.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.718 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.05 -24.26 40.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.613 0.72 . . . . 0.0 109.468 178.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -64.52 -25.2 67.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.815 179.237 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.418 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 47.6 tt0 -77.56 -43.89 30.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.277 -179.417 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -52.94 -29.69 30.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.188 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -76.03 -50.57 14.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.346 -179.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.582 HG13 HG23 ' A' ' 27' ' ' ILE . 28.3 t -66.19 -53.1 40.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.509 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.418 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.5 mttt -50.52 -30.51 13.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.353 -179.497 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.06 -11.06 36.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.435 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.778 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.106 -179.86 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.932 0.396 . . . . 0.0 110.906 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.778 HG12 HD13 ' A' ' 21' ' ' LEU . 2.8 mp -55.88 -29.46 26.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.769 -179.589 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.23 -56.27 24.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.201 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.02 -32.57 69.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 111.091 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.956 HD23 ' HG ' ' A' ' 60' ' ' LEU . 4.5 mt -70.7 -21.13 62.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.555 -179.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -78.1 -57.61 3.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.048 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -58.42 6.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.85 0.357 . . . . 0.0 111.789 -179.138 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -62.2 -25.02 67.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -179.338 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.15 -57.53 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.912 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.77 -54.12 26.01 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.596 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.495 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.5 tm-20 -47.94 -28.38 2.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.033 0.444 . . . . 0.0 111.204 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.012 HD21 HG22 ' A' ' 57' ' ' VAL . 9.2 tp -70.96 -40.58 71.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.3 -179.563 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -61.88 -58.33 8.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.604 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -51.42 -28.04 11.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.386 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.0 -28.66 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.88 -179.955 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.511 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.8 mt -75.18 -31.61 24.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.673 179.654 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -69.77 -31.45 69.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.392 179.642 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -75.61 -29.47 59.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.483 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.6 mt . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.954 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.821 0.343 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.9 p -50.7 -29.55 7.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.53 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -72.06 -29.91 64.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.158 -179.863 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -67.4 -57.25 6.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 -179.821 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.509 ' O ' HG23 ' A' ' 57' ' ' VAL . 43.6 t -59.61 -25.92 33.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.53 -37.08 85.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.95 0.405 . . . . 0.0 110.472 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.04 -27.87 62.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.719 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.98 -29.01 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.031 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.012 HG22 HD21 ' A' ' 37' ' ' LEU . 22.3 t -83.23 -25.69 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.177 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -75.2 -28.34 59.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.506 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -39.44 59.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.646 -179.088 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.956 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -77.25 -24.88 51.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.54 0.21 . . . . 0.0 111.52 -179.566 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -55.01 13.07 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.008 0.432 . . . . 0.0 110.283 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.94 -26.92 68.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.976 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.8 mt-10 -60.45 -51.33 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.026 -179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.861 ' CG1' HD22 ' A' ' 30' ' ' LEU . 24.4 mt -59.39 -25.68 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -34.68 75.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.833 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.756 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.551 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.4 OUTLIER . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.733 0.301 . . . . 0.0 111.173 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.565 ' HG2' HG21 ' A' ' 41' ' ' ILE . 33.2 mt-10 -83.16 -39.71 20.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.605 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -19.71 64.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.147 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.67 -55.13 9.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.63 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.0 t -62.56 -29.34 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.52 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -36.98 75.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.654 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.75 -23.87 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.566 0.698 . . . . 0.0 109.721 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.699 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -66.61 -25.09 66.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.919 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 30.3 tt0 -79.12 -52.71 7.82 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.438 -179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -47.36 -30.23 3.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.837 0.351 . . . . 0.0 111.329 -179.647 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.571 ' HD3' HG21 ' A' ' 64' ' ' ILE . 15.5 tttm -76.19 -36.86 58.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.011 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.644 HG22 HD13 ' A' ' 64' ' ' ILE . 24.9 t -78.21 -54.22 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.35 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -50.53 -29.83 11.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.44 -179.493 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.35 -12.83 36.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.444 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.945 -179.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -27.7 59.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.888 0.375 . . . . 0.0 111.099 -179.973 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 36.2 mt -68.29 -29.6 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -179.673 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.05 -56.12 17.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.702 -179.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -57.86 -35.95 71.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 0.0 111.223 -179.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 64.9 mt -70.72 -21.32 62.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.691 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -75.28 -59.14 2.88 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -51.97 41.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.196 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.459 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 5.1 ttpt -67.55 -24.93 65.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.413 . . . . 0.0 112.084 -179.198 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.91 -57.74 11.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.951 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.66 -54.09 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.055 -178.704 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.487 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 5.9 tt0 -48.25 -28.57 3.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.075 0.464 . . . . 0.0 111.103 -179.826 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.992 HD21 HG22 ' A' ' 57' ' ' VAL . 8.4 tp -69.47 -40.29 77.2 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.186 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -58.13 9.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.358 -179.769 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -54.65 -29.44 52.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.293 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.45 -26.82 68.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.0 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 44' ' ' LEU . 8.2 mt -75.39 -30.2 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 110.819 179.776 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.11 -45.8 83.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.616 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -62.14 -38.87 90.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.378 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.936 HD11 HG21 ' A' ' 53' ' ' VAL . 11.0 mt . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.072 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.702 0.287 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 16.1 t -54.91 -23.89 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.341 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -72.36 -34.96 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.012 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -66.6 -57.32 7.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.936 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -57.55 -25.95 25.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.342 179.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.551 ' HG2' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -66.0 -37.74 86.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.921 0.391 . . . . 0.0 110.62 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.37 -27.89 62.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.859 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -71.07 -28.89 64.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.992 HG22 HD21 ' A' ' 37' ' ' LEU . 21.5 t -83.32 -25.98 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -75.46 -28.61 59.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.795 -179.49 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -39.96 63.05 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -178.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.38 -26.21 46.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.228 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -40.35 70.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.969 0.414 . . . . 0.0 110.892 -179.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -76.48 -26.83 55.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.227 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.578 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.51 -59.28 4.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.153 -179.739 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.644 HD13 HG22 ' A' ' 18' ' ' VAL . 38.7 mt -51.97 -27.95 9.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -62.17 -33.15 73.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.858 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.852 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.832 0.348 . . . . 0.0 111.149 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -71.32 -33.89 70.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.21 -19.53 56.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.509 -179.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.58 -39.07 32.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.814 -179.232 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.424 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.1 t -79.16 -29.55 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -65.51 -34.68 78.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.054 0.454 . . . . 0.0 110.087 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.63 -25.07 35.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.606 178.463 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.649 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.7 tt -66.55 -25.6 66.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.863 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -76.77 -46.33 25.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.018 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -51.75 -27.05 10.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.02 -43.85 42.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.069 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.573 HG22 HD13 ' A' ' 64' ' ' ILE . 2.3 t -76.78 -57.45 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.258 -179.807 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -53.06 -23.83 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.236 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -18.14 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.125 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.58 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.2 pp . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.941 179.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.582 -0.207 . . . . 0.0 112.582 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -27.65 54.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.322 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' CD1' ' A' ' 21' ' ' LEU . 53.7 mt -65.08 -29.64 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.479 -179.63 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -64.15 -56.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.697 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.13 -28.02 67.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.693 0.282 . . . . 0.0 111.328 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.709 ' O ' HD11 ' A' ' 60' ' ' LEU . 88.5 mt -76.5 -21.62 55.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.639 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -78.22 -59.52 2.74 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.42 -36.96 46.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.829 -179.258 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.704 ' HE2' HD12 ' A' ' 60' ' ' LEU . 2.6 ttpt -82.19 -24.81 34.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.141 -179.152 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.12 -57.88 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.479 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -42.46 79.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.85 -28.2 67.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.096 0.474 . . . . 0.0 110.918 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.087 HD21 HG22 ' A' ' 57' ' ' VAL . 7.0 tp -69.04 -44.74 72.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.554 -179.29 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -59.88 -58.25 9.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.777 0.322 . . . . 0.0 111.544 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -54.31 -27.81 38.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.22 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 1.7 tptp -67.63 -25.98 66.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.057 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 44' ' ' LEU . 7.2 mt -77.1 -34.01 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.86 0.362 . . . . 0.0 110.48 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.6 -30.81 71.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.385 179.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.8 pt-20 -78.01 -29.45 49.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.477 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.859 HD11 HG21 ' A' ' 53' ' ' VAL . 14.6 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 -179.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 CA--C 1.528 0.122 0 CA-C-O 120.673 0.273 . . . . 0.0 111.267 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -68.29 -19.7 24.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.445 179.928 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -76.94 -26.48 54.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.331 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -57.14 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 0.0 110.591 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.859 HG21 HD11 ' A' ' 44' ' ' LEU . 21.3 t -54.04 -31.98 22.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -59.17 -38.99 81.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.983 0.42 . . . . 0.0 110.616 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -71.88 -27.69 63.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.743 179.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -67.1 -28.62 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.087 HG22 HD21 ' A' ' 37' ' ' LEU . 11.0 t -82.38 -25.6 8.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.037 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.19 60.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.466 -179.619 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.19 -40.48 52.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -178.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.709 HD11 ' O ' ' A' ' 30' ' ' LEU . 1.1 tt -77.0 -24.83 52.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.23 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.69 -54.63 11.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.02 0.438 . . . . 0.0 110.483 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -63.61 -26.96 68.92 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.961 179.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.595 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.9 tm-20 -61.27 -58.71 7.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.048 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.573 HD13 HG22 ' A' ' 18' ' ' VAL . 32.1 mt -54.08 -27.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.197 179.843 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -32.9 74.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.701 179.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.482 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.1 tt . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.782 0.325 . . . . 0.0 111.047 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.02 -33.7 68.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.263 -179.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.25 -19.94 55.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.473 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -45.52 65.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.46 -179.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.669 HG22 HG13 ' A' ' 57' ' ' VAL . 22.0 t -78.38 -29.18 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 -179.394 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -35.6 81.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.141 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -26.59 35.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.476 0.655 . . . . 0.0 109.62 178.711 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.626 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -64.38 -25.39 68.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.913 179.557 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.86 -45.51 24.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.0 -26.82 11.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -48.6 19.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.648 HG22 HD13 ' A' ' 64' ' ' ILE . 3.3 t -70.9 -56.04 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.58 -20.49 8.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.05 -16.01 27.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.633 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.762 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.764 0.316 . . . . 0.0 111.002 -179.86 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -27.84 26.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 -179.915 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.762 HG21 HD11 ' A' ' 21' ' ' LEU . 16.7 mt -68.79 -29.64 44.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.442 -179.485 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.91 -56.07 17.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.527 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -55.95 -26.9 50.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 -179.722 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.691 HD22 ' HG ' ' A' ' 60' ' ' LEU . 56.1 mt -81.09 -21.14 40.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.785 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -74.43 -54.42 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.722 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -54.55 -52.11 63.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.752 0.311 . . . . 0.0 111.761 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.9 ttpp -66.69 -25.08 66.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.924 -179.408 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.75 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.067 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.99 -56.16 11.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.127 -178.593 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.516 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 20.3 tt0 -47.85 -28.5 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 111.348 -179.688 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.04 HD21 HG22 ' A' ' 57' ' ' VAL . 6.2 tp -68.99 -38.68 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.472 -179.459 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -66.38 -58.26 5.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.399 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -52.19 -28.02 16.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.449 -179.629 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -69.34 -25.91 64.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mt -77.8 -34.91 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 110.734 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.93 -29.67 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 179.719 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -78.5 -30.89 47.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 110.575 179.734 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.5 mt . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.869 179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.718 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.2 tt0 . . . . . 0 N--CA 1.457 -0.09 0 CA-C-O 120.781 0.324 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.8 p -53.05 -30.17 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.281 -179.904 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -67.64 -38.57 84.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -60.18 -57.19 13.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.993 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.705 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -56.78 -25.87 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.471 ' HG2' HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.72 -38.53 89.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.883 0.373 . . . . 0.0 110.592 179.853 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.36 -27.86 63.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.804 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.62 -28.9 65.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.06 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.04 HG22 HD21 ' A' ' 37' ' ' LEU . 23.0 t -83.12 -25.82 7.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.42 -28.49 59.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.668 -179.538 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.84 -40.52 63.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.875 -178.992 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.691 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.18 -25.83 47.36 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.238 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -71.79 -40.05 69.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.945 0.403 . . . . 0.0 110.794 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.38 -26.88 56.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.272 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.613 ' OE1' HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -63.87 -59.11 4.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -179.68 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.648 HD13 HG22 ' A' ' 18' ' ' VAL . 35.3 mt -51.87 -26.48 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.236 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -31.65 69.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.766 179.895 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.803 0.335 . . . . 0.0 111.153 . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.47 -31.84 58.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.536 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.29 -23.92 51.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.552 -179.682 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -55.2 14.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 111.338 -179.393 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.698 HG22 HG13 ' A' ' 57' ' ' VAL . 21.7 t -70.03 -28.96 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.519 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.0 -36.14 78.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.463 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.33 -24.42 39.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.513 0.673 . . . . 0.0 109.445 178.67 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.563 HD21 HD23 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -66.15 -25.22 66.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.938 179.361 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.444 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.4 tt0 -70.7 -47.04 61.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.24 -179.373 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -50.05 -26.58 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.216 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -76.1 -43.74 41.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.536 -179.775 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.441 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 2.7 t -78.13 -43.48 27.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.409 -179.498 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.7 mtpt -49.79 -36.52 26.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.028 0.442 . . . . 0.0 110.737 179.777 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.47 -10.95 35.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.795 179.294 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 18' ' ' VAL . 4.8 tp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.105 -179.56 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.41 -27.89 64.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.845 0.355 . . . . 0.0 110.988 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.1 mt -73.37 -29.83 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.13 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -65.68 -56.18 13.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.586 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.03 -36.03 74.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.865 0.364 . . . . 0.0 111.281 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.712 HD22 ' HG ' ' A' ' 60' ' ' LEU . 96.6 mt -70.7 -21.62 62.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.833 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.47 -57.25 4.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -54.83 -42.33 71.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.217 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -73.26 -25.45 60.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.638 -179.502 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.12 -57.81 10.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.938 0.399 . . . . 0.0 111.913 -179.167 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.37 -53.22 38.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.929 -178.801 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.49 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.2 tt0 -49.21 -28.55 4.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 111.176 -179.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.979 HD21 HG22 ' A' ' 57' ' ' VAL . 4.2 tp -71.44 -38.79 71.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.501 -179.522 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -58.34 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.73 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.43 -28.13 12.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.476 -179.512 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.415 ' CD ' HG22 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -69.44 -28.66 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.974 -179.876 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 HD22 ' A' ' 7' ' ' LEU . 7.2 mt -75.77 -31.92 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.896 0.379 . . . . 0.0 110.506 179.707 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -68.1 -31.88 71.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.385 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -75.8 -29.75 58.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.421 179.496 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.896 HD11 HG21 ' A' ' 53' ' ' VAL . 14.1 mt . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.527 0.066 0 CA-C-O 120.706 0.288 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.5 t -54.2 -24.1 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -66.74 -36.75 83.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -70.65 -57.11 5.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.878 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 44' ' ' LEU . 20.6 t -50.24 -26.34 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.465 -179.931 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.2 -32.67 74.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -27.95 47.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.725 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -68.66 -28.87 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.979 HG22 HD21 ' A' ' 37' ' ' LEU . 30.9 t -83.14 -25.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.811 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -74.04 -28.1 61.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.51 -179.609 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -39.41 63.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.041 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.0 -25.75 48.18 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.165 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -46.59 64.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.949 0.404 . . . . 0.0 110.88 -179.86 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -71.79 -26.98 62.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.416 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 30' ' ' LEU . 1.3 mm-40 -62.71 -59.18 5.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.031 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.45 HG12 HD13 ' A' ' 30' ' ' LEU . 38.1 mt -51.22 -28.13 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.289 179.957 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -29.76 68.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 -179.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.5 mttm . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.097 -179.905 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.638 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.805 0.336 . . . . 0.0 111.062 . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -74.3 -33.23 63.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.137 -179.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.19 -20.11 55.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.357 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.77 -43.13 38.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.333 -179.559 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.658 HG12 ' HE2' ' A' ' 38' ' ' LYS . 21.9 t -74.62 -29.06 22.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.706 -179.568 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -36.43 81.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.018 0.437 . . . . 0.0 110.352 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -23.85 37.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.548 0.689 . . . . 0.0 109.514 178.518 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.615 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -66.64 -25.06 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.054 179.527 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 54.0 tt0 -76.33 -50.63 13.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.309 -179.463 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -51.7 -26.18 8.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.783 0.325 . . . . 0.0 111.074 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -41.55 49.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.454 HG23 ' O ' ' A' ' 14' ' ' LEU . 11.7 t -78.14 -51.81 17.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.19 -179.979 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.5 -31.6 10.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.464 -179.649 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.96 -10.84 37.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.52 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.67 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.823 0.344 . . . . 0.0 110.987 -179.932 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 N-CA-C 112.437 -0.265 . . . . 0.0 112.437 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -37.53 77.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.897 0.38 . . . . 0.0 110.932 179.833 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.67 HG12 HD13 ' A' ' 21' ' ' LEU . 4.0 mt -71.19 -29.5 36.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.526 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -62.25 -56.21 20.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.7 -179.363 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.1 -51.29 70.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.959 0.409 . . . . 0.0 111.466 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.743 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.1 mt -58.4 -21.09 49.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.122 -179.128 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -74.09 -59.04 2.91 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -178.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -45.41 62.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.927 -179.234 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.417 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.23 -24.93 61.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.024 -179.167 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.16 -57.86 9.13 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.694 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.21 81.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.936 -178.644 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -56.79 -28.03 60.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.105 0.479 . . . . 0.0 110.889 179.997 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.062 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -71.34 -41.7 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.287 -179.505 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.658 ' HE2' HG12 ' A' ' 11' ' ' VAL . 20.6 mttm -58.64 -58.3 9.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.675 -179.575 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 13.8 pttt -51.64 -27.77 12.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.685 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 22.8 tttp -73.61 -25.8 60.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.459 -179.562 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.27 -39.11 34.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 111.239 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -63.92 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 179.666 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.46 -30.94 60.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.485 179.609 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.814 HD11 HG21 ' A' ' 53' ' ' VAL . 11.7 mt . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.988 179.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.799 0.333 . . . . 0.0 111.057 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -51.9 -30.27 12.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.373 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -29.12 65.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.082 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -68.87 -57.24 5.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.984 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.814 HG21 HD11 ' A' ' 44' ' ' LEU . 12.0 t -57.12 -26.91 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.34 -36.1 83.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -73.89 -27.92 61.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.768 179.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.44 -29.0 66.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.062 HG22 HD21 ' A' ' 37' ' ' LEU . 16.5 t -83.24 -25.71 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.066 179.935 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -75.11 -28.26 60.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -39.93 61.76 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.132 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.743 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -78.17 -25.73 47.36 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -178.996 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -49.45 47.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.002 0.429 . . . . 0.0 110.644 -179.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.06 -26.68 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.099 179.855 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.588 ' CB ' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -62.0 -56.33 20.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 -179.632 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.664 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -57.03 -25.87 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.264 179.969 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -62.58 -31.24 72.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.878 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.6 mttp . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.926 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.122 0 CA-C-O 120.685 0.279 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HG2' HG21 ' A' ' 41' ' ' ILE . 80.0 mt-10 -79.63 -39.91 30.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.276 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -19.78 63.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.106 -179.946 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -46.75 67.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.069 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.483 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -71.89 -29.06 32.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.604 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 -36.64 80.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.563 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.33 -24.53 37.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.589 0.709 . . . . 0.0 109.712 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -65.9 -25.07 66.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.965 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.458 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -75.67 -41.05 54.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.388 -179.273 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -54.98 -28.12 49.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.307 -179.856 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -48.42 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.487 -179.688 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.521 HG22 HD13 ' A' ' 64' ' ' ILE . 3.7 t -69.71 -47.77 68.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.491 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 4.3 mtpm? -51.43 -28.76 13.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.232 -179.71 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.11 -10.95 37.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.416 -0.274 . . . . 0.0 112.416 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.51 -62.11 1.95 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 110.942 179.872 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.475 HG23 HG13 ' A' ' 18' ' ' VAL . 7.2 mt -60.48 -29.76 45.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.524 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -56.14 26.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.772 0.32 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.83 -30.83 67.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.974 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.952 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.4 mt -70.57 -21.8 62.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.385 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -78.6 -59.32 2.83 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -53.05 -36.72 60.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.776 0.322 . . . . 0.0 111.828 -179.041 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.743 ' HE3' HD12 ' A' ' 60' ' ' LEU . 7.4 ttpp -82.04 -24.99 35.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.991 -179.321 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.68 -57.81 8.86 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.532 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -42.29 84.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.528 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.89 -28.16 65.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.013 0.435 . . . . 0.0 110.995 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.002 HD21 HG22 ' A' ' 57' ' ' VAL . 2.9 tp -70.41 -47.0 62.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.52 -179.244 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -58.17 9.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 111.411 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -27.92 13.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.441 -179.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 5.3 tttp -69.87 -29.6 66.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.036 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.5 mt -75.11 -31.79 25.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.756 179.774 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -31.44 69.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.494 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.89 -29.9 58.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.574 179.667 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.52 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.4 mt . . . . . 0 C--N 1.326 -0.432 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.894 -179.885 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.419 ' HG2' HD21 ' A' ' 44' ' ' LEU . 3.8 tt0 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.795 0.331 . . . . 0.0 111.024 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.4 t -55.63 -23.2 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.415 179.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.2 tttt -72.9 -32.47 65.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.943 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -65.93 -57.17 8.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.837 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.7 t -57.8 -28.05 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 179.883 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.67 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.945 0.402 . . . . 0.0 110.617 179.812 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -68.67 -27.86 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.784 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -70.26 -28.76 65.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.028 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.002 HG22 HD21 ' A' ' 37' ' ' LEU . 12.2 t -82.11 -25.81 9.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -75.18 -28.64 60.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.259 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -37.48 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.613 -179.229 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.952 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.2 tt -76.59 -27.69 55.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.405 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -56.18 11.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.051 0.453 . . . . 0.0 110.49 179.868 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -62.65 -26.87 68.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.821 179.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.826 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.91 -44.54 97.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.956 -179.92 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 13.9 mt -67.35 -24.26 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 110.885 179.505 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -33.87 76.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.769 179.925 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.732 0.301 . . . . 0.0 111.239 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.445 ' HG3' HG21 ' A' ' 41' ' ' ILE . 84.1 mt-10 -77.2 -33.62 56.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.405 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.22 -24.58 59.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.104 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -70.42 -52.0 25.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.503 HG22 ' CG1' ' A' ' 57' ' ' VAL . 26.1 t -63.65 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 -179.976 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -38.21 70.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.55 -28.85 46.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.544 0.688 . . . . 0.0 109.485 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.712 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.8 tt -59.75 -25.22 64.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.812 179.121 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.438 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.6 tt0 -77.73 -43.52 30.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.305 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -52.28 -30.98 30.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.179 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -76.06 -37.23 58.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.294 -179.835 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.539 HG22 HD13 ' A' ' 64' ' ' ILE . 20.2 t -78.1 -53.46 14.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.626 -179.594 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.438 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -49.77 -30.11 8.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.499 -179.468 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.8 -12.88 37.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.436 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.41 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.014 -179.984 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.554 -0.219 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -27.58 64.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 111.062 -179.981 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.41 HG12 HD13 ' A' ' 21' ' ' LEU . 37.5 mt -70.74 -29.56 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.499 -179.597 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.07 -56.27 16.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.815 -179.156 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.73 -38.66 82.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.4 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.71 ' O ' HD11 ' A' ' 60' ' ' LEU . 80.0 mt -67.78 -21.37 65.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.841 -179.369 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.08 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.59 -43.16 65.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 0.0 111.778 -179.279 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 60' ' ' LEU . 7.1 ttpt -74.73 -24.95 58.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.908 -179.288 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -57.98 8.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.746 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.81 -51.33 34.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.814 -178.709 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.462 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.7 tt0 -50.86 -28.24 9.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.884 179.904 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.042 HD21 HG22 ' A' ' 57' ' ' VAL . 9.6 tp -70.26 -41.81 72.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.424 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.07 -58.23 9.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.647 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -52.97 -27.77 20.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.347 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 3.7 tppp? -70.46 -25.67 63.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.445 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.5 mt -76.71 -36.95 27.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 0.0 111.083 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -67.95 -29.63 68.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.764 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -77.66 -29.95 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.15 0.5 . . . . 0.0 110.551 179.552 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.545 HD21 ' HG2' ' A' ' 49' ' ' GLU . 4.2 mt . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.152 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.8 tt0 . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.1 -20.26 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.469 -179.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -32.16 64.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.215 -179.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.2 ttpp -67.95 -57.3 6.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.557 ' O ' HG23 ' A' ' 57' ' ' VAL . 51.4 t -58.99 -25.98 31.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.044 179.959 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -37.99 88.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.504 179.798 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -71.31 -28.77 64.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.684 179.722 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.66 -28.89 66.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.042 HG22 HD21 ' A' ' 37' ' ' LEU . 18.7 t -83.06 -25.69 8.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.013 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -28.36 60.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.568 -179.606 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -38.73 58.11 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.078 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.826 HD12 ' HE2' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -77.58 -25.55 50.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.256 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.13 -54.99 10.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.01 0.433 . . . . 0.0 110.509 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.8 -26.92 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.526 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.45 -59.11 5.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.17 -179.666 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.539 HD13 HG22 ' A' ' 18' ' ' VAL . 36.6 mt -52.73 -27.45 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.387 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -64.75 -29.87 70.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.916 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.1 mttm . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.017 -179.925 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.652 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.718 0.294 . . . . 0.0 111.307 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.42 ' HG3' HG21 ' A' ' 41' ' ' ILE . 32.1 mt-10 -78.67 -38.34 39.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.458 -179.452 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -19.86 62.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.534 -179.633 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -73.06 -53.7 10.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 -179.734 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 57' ' ' VAL . 21.8 t -63.89 -29.31 46.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.72 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -58.57 -37.06 74.95 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.727 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.22 -23.91 40.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.582 0.706 . . . . 0.0 109.463 178.73 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.616 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.23 -25.22 67.59 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.946 179.36 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -74.24 -42.1 60.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.117 -179.38 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -56.81 -26.02 57.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.176 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -51.88 11.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.432 -179.768 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.459 HG22 HD13 ' A' ' 64' ' ' ILE . 8.5 t -68.12 -47.79 76.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.446 -179.697 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.5 mtpt -50.81 -27.16 6.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.327 -179.704 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.13 -10.86 37.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.533 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.641 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.451 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.667 -179.832 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.461 -0.256 . . . . 0.0 112.461 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -27.64 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.814 0.34 . . . . 0.0 111.023 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.641 HG12 HD13 ' A' ' 21' ' ' LEU . 23.8 mt -68.55 -29.67 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.459 -179.537 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.96 -56.15 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.64 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.18 -30.43 70.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 111.281 -179.497 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.729 ' O ' HD11 ' A' ' 60' ' ' LEU . 95.0 mt -73.6 -21.35 60.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.491 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -78.06 -59.4 2.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.728 -179.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -33.59 59.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.793 0.33 . . . . 0.0 111.566 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -81.96 -24.89 35.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.813 -179.521 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -65.71 -58.05 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.766 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.9 -41.94 74.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.878 -178.832 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.5 -28.27 66.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.037 0.446 . . . . 0.0 110.789 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.098 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -70.26 -40.75 74.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.461 -179.41 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -61.72 -58.32 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.599 -179.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -50.59 -28.27 8.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.559 -179.601 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -69.79 -28.42 65.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.87 -179.995 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.42 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.3 mt -76.2 -30.26 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.586 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.89 -33.34 73.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.244 179.468 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.494 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -74.5 -30.61 61.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.342 179.61 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.909 HD11 HG21 ' A' ' 53' ' ' VAL . 13.3 mt . . . . . 0 C--N 1.327 -0.387 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.843 179.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.431 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.4 tp10 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.634 0.254 . . . . 0.0 111.246 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.32 -18.85 12.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.625 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -74.65 -29.88 61.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.201 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -78.0 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.089 -179.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.909 HG21 HD11 ' A' ' 44' ' ' LEU . 17.1 t -57.23 -25.86 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.29 -179.993 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.8 -35.17 79.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.392 . . . . 0.0 110.55 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -75.18 -27.67 59.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.739 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -69.29 -30.77 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.115 -179.827 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.098 HG22 HD21 ' A' ' 37' ' ' LEU . 9.6 t -83.3 -25.57 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.183 -179.958 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.98 -27.97 60.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.579 -179.524 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -76.06 -39.54 55.23 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -178.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.729 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -77.97 -25.26 48.03 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.273 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -52.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.05 0.452 . . . . 0.0 110.715 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -66.5 -26.92 67.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.225 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.678 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.4 tm-20 -61.89 -56.12 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.459 HD13 HG22 ' A' ' 18' ' ' VAL . 30.0 mt -56.15 -26.8 22.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.045 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -34.22 75.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.81 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.7 mmtt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.606 179.854 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.3 tt . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.792 0.33 . . . . 0.0 111.03 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -73.87 -32.99 63.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.17 -20.21 55.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.341 -179.84 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -51.13 48.05 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.894 0.378 . . . . 0.0 111.101 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.498 HG22 HG13 ' A' ' 57' ' ' VAL . 24.4 t -72.7 -29.19 29.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.44 -179.783 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -61.44 -36.57 80.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.406 179.985 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.26 -24.01 37.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.499 0.666 . . . . 0.0 109.56 178.623 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.503 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -66.01 -25.21 66.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.883 179.403 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.405 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.2 tt0 -75.36 -47.78 26.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.221 -179.585 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -50.25 -28.23 7.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.157 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -76.11 -41.71 49.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.342 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.478 HG23 ' O ' ' A' ' 14' ' ' LEU . 2.5 t -75.46 -55.08 12.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.422 -179.705 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 6.0 mtpt -50.82 -29.33 11.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.357 -179.661 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.08 -11.68 35.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.4 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.928 -179.965 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.481 -0.248 . . . . 0.0 112.481 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.1 -27.82 47.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 0.0 111.102 -179.913 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 71.4 mt -76.25 -29.58 19.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.291 -179.604 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -68.39 -45.76 71.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.184 -179.752 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -69.19 -29.35 67.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.389 . . . . 0.0 110.818 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.879 HD21 ' HB3' ' A' ' 63' ' ' GLU . 24.1 mt -74.53 -21.89 59.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.293 -179.841 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.65 -59.34 2.82 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.878 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -50.42 -56.85 9.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.647 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.618 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -63.8 -24.99 67.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.18 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.44 -57.62 11.46 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.659 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.2 OUTLIER -68.96 -54.49 15.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.588 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.498 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.3 tt0 -47.78 -28.75 2.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.031 0.443 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.987 HD21 HG22 ' A' ' 57' ' ' VAL . 3.0 tp -69.81 -38.37 76.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.197 -179.733 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 17.4 mttp -63.62 -58.2 7.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -50.66 -27.95 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.29 -179.854 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -70.56 -28.43 64.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.862 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.0 mt -74.07 -31.94 31.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.99 0.424 . . . . 0.0 110.58 179.614 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -67.86 -35.83 79.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.327 179.516 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -71.59 -29.37 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 179.568 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.614 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.1 mt . . . . . 0 C--N 1.327 -0.382 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.921 -179.984 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.556 HG22 HD22 ' A' ' 44' ' ' LEU . 25.1 t -54.89 -24.02 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.387 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -71.17 -29.44 65.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.013 -179.985 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.8 tptt -71.17 -57.26 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.89 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.614 ' CG2' HD11 ' A' ' 44' ' ' LEU . 25.0 t -55.49 -27.66 21.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.936 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.97 -31.84 73.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 110.649 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -79.55 -27.77 41.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -68.87 -28.73 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.319 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.987 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.1 -25.52 8.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.15 -28.53 60.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.442 -179.66 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -40.46 52.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.742 -179.149 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.783 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -76.2 -25.1 54.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.589 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -55.96 9.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.21 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.52 -26.79 68.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -60.59 -50.01 75.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.992 -179.919 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.617 HG12 HD13 ' A' ' 30' ' ' LEU . 14.2 mt -68.19 -22.79 27.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.784 179.452 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -38.74 67.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.383 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 mttp . . . . . 0 C--N 1.328 -0.342 0 CA-C-O 120.977 0.418 . . . . 0.0 110.733 -179.979 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.831 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER . . . . . 0 CA--C 1.527 0.093 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -78.05 -33.48 50.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.556 -179.397 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -19.8 56.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.77 0.319 . . . . 0.0 111.67 -179.743 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -47.38 23.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.796 -179.166 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.628 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.6 t -74.79 -29.12 22.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.907 -179.264 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 ttpp -63.25 -36.25 83.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.324 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.52 -23.86 37.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.57 0.7 . . . . 0.0 109.753 178.722 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.612 HD21 HD23 ' A' ' 60' ' ' LEU . 1.6 tt -68.07 -25.12 65.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.211 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.414 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.1 tt0 -75.0 -51.88 12.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.495 -179.4 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -50.2 -26.98 5.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.322 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -43.87 41.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.21 179.976 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.629 HG22 HD13 ' A' ' 64' ' ' ILE . 21.3 t -76.12 -48.12 29.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.556 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.414 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -49.59 -31.7 11.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.518 -179.552 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.13 -11.04 39.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.505 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.48 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.99 -179.869 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.372 0 N-CA-C 112.573 -0.211 . . . . 0.0 112.573 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.5 -53.22 60.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.901 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.48 HG12 HD13 ' A' ' 21' ' ' LEU . 12.4 mt -60.21 -29.48 44.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.628 -179.473 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -59.09 -56.22 24.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.651 -179.265 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -58.45 -36.89 74.37 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.923 0.392 . . . . 0.0 111.225 -179.574 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.86 HD23 ' HG ' ' A' ' 60' ' ' LEU . 6.5 mt -66.77 -21.79 66.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.887 -179.387 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 tttm -78.63 -59.54 2.74 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.831 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -37.41 56.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -178.921 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.766 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.8 ttpm? -82.25 -24.67 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.204 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.84 -57.81 7.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.494 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -40.85 77.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.67 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.5 tt0 -59.74 -27.78 66.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.13 0.49 . . . . 0.0 110.659 179.869 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 1.061 HD21 HG22 ' A' ' 57' ' ' VAL . 6.8 tp -75.81 -40.02 55.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.66 -179.234 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.81 -33.23 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.842 -179.311 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 4.2 ptmt -79.05 -30.45 44.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.058 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -63.28 -26.0 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.893 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.3 mt -73.55 -30.08 28.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.622 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.7 -35.63 75.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.435 179.519 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -71.71 -28.8 63.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.479 179.603 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.69 HD13 HG23 ' A' ' 50' ' ' VAL . 5.3 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.988 179.985 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.69 HG23 HD13 ' A' ' 44' ' ' LEU . 14.4 p -54.16 -30.04 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.308 -179.925 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -33.46 74.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.061 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -57.29 12.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.864 -179.837 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.534 ' O ' HG23 ' A' ' 57' ' ' VAL . 39.7 t -55.11 -26.08 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.109 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.78 -34.35 77.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.025 0.441 . . . . 0.0 110.373 179.588 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -76.3 -28.16 56.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.469 179.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.23 -28.76 68.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.881 179.826 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 1.061 HG22 HD21 ' A' ' 37' ' ' LEU . 4.5 t -81.81 -25.42 9.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.898 179.885 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.7 -28.47 61.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.263 -179.852 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -74.51 -38.69 62.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.738 -179.373 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.86 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.0 tt -76.58 -26.01 54.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.343 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.36 -56.26 9.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.01 0.433 . . . . 0.0 110.289 179.82 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -61.85 -26.64 68.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.36 179.242 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.805 ' CB ' HD21 ' A' ' 30' ' ' LEU . 3.2 mm-40 -61.16 -45.0 96.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 14.8 mt -68.48 -23.76 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.023 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -34.34 76.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mtpm? . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.6 179.838 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.9 m -149.3 -47.07 0.14 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.77 0.319 . . . . 0.0 110.922 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.8 -72.56 0.26 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.97 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -83.19 -42.76 17.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.331 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.6 tptt -57.67 -30.49 65.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.047 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -83.18 -25.75 31.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.335 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.577 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER -61.94 -46.99 86.87 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.627 -179.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -62.01 -32.84 73.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.961 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.497 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 2.5 pt-20 -77.44 -19.96 55.25 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.58 -50.14 19.09 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.946 0.351 . . . . 0.0 111.946 -178.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.53 HG22 HG13 ' A' ' 57' ' ' VAL . 25.8 t -74.83 -29.26 22.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -36.57 81.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.925 0.393 . . . . 0.0 110.434 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -24.22 37.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.535 0.683 . . . . 0.0 109.547 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.94 -25.11 66.98 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 114.728 -1.124 . . . . 0.0 110.954 179.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.423 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.9 tt0 -77.67 -44.46 27.99 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.168 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -52.31 -27.28 14.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.212 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -53.19 8.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.225 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.648 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.3 t -64.8 -52.03 59.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.312 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 12.1 mttt -52.23 -25.65 9.81 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.448 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.61 -11.04 38.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.337 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.562 HD11 HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.84 -156.59 0.1 Allowed 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.526 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.443 ' H ' HD22 ' A' ' 21' ' ' LEU . . . 178.86 148.96 7.92 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.542 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 105.04 160.96 23.64 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.739 -0.744 . . . . 0.0 112.539 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 -169.79 34.62 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.466 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 94.25 -111.43 4.16 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.533 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.416 ' HG2' HD22 ' A' ' 67' ' ' LEU . 0.1 OUTLIER -69.49 -27.75 65.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.776 0.322 . . . . 0.0 111.034 -179.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.408 HG12 HD13 ' A' ' 21' ' ' LEU . 33.1 mt -72.73 -29.53 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.442 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.08 -56.17 12.83 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.804 -179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.61 -35.98 77.47 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 111.483 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.666 ' O ' HD11 ' A' ' 60' ' ' LEU . 83.6 mt -71.1 -21.48 62.21 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.944 -179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -76.37 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 mttm -54.04 -43.04 69.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.84 0.352 . . . . 0.0 111.496 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.455 ' HA ' ' HG2' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -72.54 -25.11 61.25 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.695 -179.466 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.85 -57.77 8.83 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -178.805 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.18 -49.15 62.76 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.513 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HG2' ' HA ' ' A' ' 33' ' ' LYS . 11.9 pt-20 -54.32 -28.55 43.24 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.078 0.466 . . . . 0.0 110.989 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.049 HD21 HG22 ' A' ' 57' ' ' VAL . 8.1 tp -67.72 -41.98 82.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.064 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -58.21 9.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.287 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptpm? -51.11 -28.02 9.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.318 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 ttmm -70.91 -25.9 62.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.875 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.577 HD13 HD22 ' A' ' 7' ' ' LEU . 6.8 mt -77.84 -30.54 16.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.824 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -67.45 -41.03 85.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.588 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.422 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.9 pt-20 -66.84 -35.42 80.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.513 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.763 HD11 ' CG2' ' A' ' 53' ' ' VAL . 10.9 mt -55.31 170.56 0.21 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.113 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -117.81 -112.06 2.57 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.424 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -108.7 -45.18 1.06 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.495 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -147.59 -175.2 20.17 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.494 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.25 -99.99 2.47 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.489 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -62.95 -18.01 62.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.703 0.287 . . . . 0.0 111.205 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 18.3 t -55.37 -22.31 11.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.504 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.5 mttm -72.33 -36.08 68.76 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.097 -179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.0 tptp -64.83 -57.41 8.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.961 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.763 ' CG2' HD11 ' A' ' 44' ' ' LEU . 28.0 t -57.96 -26.28 28.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -64.27 -37.32 87.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.961 0.41 . . . . 0.0 110.414 179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -71.85 -28.18 63.38 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.577 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -68.78 -29.46 67.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.872 179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.049 HG22 HD21 ' A' ' 37' ' ' LEU . 19.7 t -83.25 -25.55 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.026 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -73.83 -28.26 61.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.522 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -75.37 -44.0 47.34 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -179.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.666 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.02 -25.12 59.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.402 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.8 OUTLIER -70.43 -55.3 9.36 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.055 0.455 . . . . 0.0 110.752 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -62.22 -26.81 68.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.214 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -56.74 14.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.413 -179.5 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.785 HG23 HD11 ' A' ' 67' ' ' LEU . 21.5 mt -58.19 -24.57 24.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.345 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 -31.76 58.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.515 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtp -106.99 -68.1 0.91 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.755 0.312 . . . . 0.0 111.364 -179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.785 HD11 HG23 ' A' ' 64' ' ' ILE . 97.5 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.95 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.648 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.529 -0.228 . . . . 0.0 112.529 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.4 m -135.98 159.0 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.815 0.34 . . . . 0.0 110.865 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -176.49 -39.98 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.963 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.528 HG22 HG21 ' A' ' 50' ' ' VAL . 21.4 t -79.78 -28.63 12.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.239 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mptp? -68.39 -29.54 68.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.93 0.395 . . . . 0.0 110.724 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.12 -25.47 31.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.283 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -66.19 -49.55 66.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.536 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -61.51 -34.83 76.16 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.884 -179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.1 -19.57 56.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.722 0.296 . . . . 0.0 111.604 -179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -71.8 -44.51 63.82 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.671 -179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.578 HG22 ' CG1' ' A' ' 57' ' ' VAL . 19.3 t -79.1 -29.05 13.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.913 -179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -36.53 83.95 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.248 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.68 -26.66 34.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.545 0.688 . . . . 0.0 109.565 178.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.57 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -64.28 -25.15 67.92 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.09 179.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.403 ' HG2' ' CG ' ' A' ' 19' ' ' LYS . 1.2 tm-20 -76.85 -56.06 4.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.341 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -47.07 -27.91 1.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.491 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tptm -76.03 -41.62 50.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.345 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.661 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 22.1 t -76.13 -48.59 27.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.523 -179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.403 ' CG ' ' HG2' ' A' ' 15' ' ' GLU . 1.7 mtpt -49.16 -32.89 11.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.348 -179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -11.0 43.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.591 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.74 HD23 ' H ' ' A' ' 22' ' ' GLY . 0.3 OUTLIER -65.44 164.71 13.31 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 120.876 0.37 . . . . 0.0 110.83 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.74 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -139.77 120.6 1.86 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.513 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 147.85 -176.13 26.83 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.555 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -135.89 -179.34 16.53 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.484 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.41 -91.2 0.74 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.471 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.494 ' CD ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -54.54 -60.28 3.56 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.906 0.384 . . . . 0.0 111.05 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.534 ' HA ' HD12 ' A' ' 30' ' ' LEU . 4.1 mt -55.0 -29.64 22.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.501 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.16 -56.26 23.75 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.293 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -57.39 -28.95 63.67 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.9 0.381 . . . . 0.0 110.957 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.926 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.2 mt -74.54 -21.56 59.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.539 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.11 -59.2 2.88 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -50.05 -42.39 49.68 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.585 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -80.88 -25.21 37.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.19 -57.57 12.23 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.83 -55.73 15.58 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.459 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.501 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.4 tt0 -47.94 -28.39 2.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.039 0.447 . . . . 0.0 111.246 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.02 HD21 HG22 ' A' ' 57' ' ' VAL . 12.1 tp -71.41 -38.29 71.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.454 -179.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.436 ' HD2' HG12 ' A' ' 11' ' ' VAL . 0.2 OUTLIER -64.81 -58.28 6.64 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.536 -179.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.28 -27.8 10.29 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.348 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 1.8 tptt -70.38 -25.58 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.239 -179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.9 mt -77.63 -37.26 24.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 0.0 110.839 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.25 -29.71 69.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.779 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 4.4 pt-20 -78.4 -30.51 47.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.559 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.784 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.4 mt -59.61 162.63 4.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.037 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -105.81 -46.8 1.16 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.454 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 135.84 69.29 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.596 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 133.21 145.81 5.45 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.536 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.37 -64.56 4.25 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.562 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.784 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.1 tt0 -95.07 -22.84 17.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.755 0.312 . . . . 0.0 110.986 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.528 HG21 HG22 ' A' ' 4' ' ' VAL . 14.9 p -52.85 -29.39 14.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.427 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.01 -40.85 87.37 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.082 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 tptm -60.03 -57.09 14.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.066 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.616 ' CG2' HD11 ' A' ' 44' ' ' LEU . 24.4 t -55.79 -25.87 19.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.24 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -65.84 -37.84 87.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.834 0.35 . . . . 0.0 110.556 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -72.07 -27.98 63.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.795 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -70.61 -28.89 65.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.995 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.02 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.25 -25.56 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.054 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.13 -28.64 60.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.4 -179.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -39.67 54.7 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.571 -179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.926 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.5 tt -75.14 -25.25 58.24 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.652 -0.249 . . . . 0.0 111.481 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.34 -56.1 8.5 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.951 0.405 . . . . 0.0 110.496 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -60.93 -26.96 67.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.62 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.869 ' HB3' HD21 ' A' ' 30' ' ' LEU . 2.2 mt-10 -61.66 -46.76 88.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.865 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.812 HG12 HD22 ' A' ' 30' ' ' LEU . 17.2 mt -65.26 -24.2 34.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.01 179.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -66.31 -31.77 72.76 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.911 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.1 mtmt -64.42 -61.12 2.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.983 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.598 HD21 ' HA ' ' A' ' 64' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.087 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.661 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.241 0 N-CA-C 112.482 -0.247 . . . . 0.0 112.482 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.1 m -85.57 -177.99 6.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.7 ttm-85 -172.12 -42.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.866 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.78 -28.16 40.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.237 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 4.9 pttm -58.74 -34.97 71.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.846 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.87 -25.57 53.23 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.104 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.11 -28.84 66.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.117 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.501 ' CG ' HG21 ' A' ' 41' ' ' ILE . 20.8 mt-10 -81.93 -43.35 18.22 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.364 -179.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -66.41 -19.87 65.91 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.423 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.67 -53.98 9.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.302 -179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.472 HG22 ' CG1' ' A' ' 57' ' ' VAL . 36.8 t -60.56 -29.23 44.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.723 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.16 -37.23 74.3 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.84 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.41 -23.8 40.12 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.47 0.653 . . . . 0.0 109.522 178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.581 HD21 HD23 ' A' ' 60' ' ' LEU . 1.3 tt -65.51 -25.12 67.32 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.915 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.4 tt0 -75.28 -46.43 33.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.098 -179.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -53.22 -27.71 23.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -41.31 50.66 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.088 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.677 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 25.3 t -78.14 -51.78 17.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.579 -179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -49.82 -31.1 11.05 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.49 -179.559 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.89 -11.59 38.75 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.464 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.864 HD11 HD13 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -65.11 -69.05 0.32 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.997 -179.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 76.77 142.39 1.38 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.448 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 134.0 -165.09 24.39 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.528 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.35 144.86 15.06 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.513 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.01 -93.32 0.77 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.611 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.48 ' HB3' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.37 -55.47 20.9 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.738 0.304 . . . . 0.0 111.041 -179.933 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.591 HD12 ' H ' ' A' ' 27' ' ' ILE . 4.6 mp -58.5 -29.67 39.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.717 -179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.0 -56.21 21.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.714 0.292 . . . . 0.0 111.299 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.09 -26.82 64.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.191 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.884 HD23 ' HG ' ' A' ' 60' ' ' LEU . 5.6 mt -76.66 -21.68 55.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.519 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 15.9 tttt -78.56 -59.35 2.82 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -178.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.8 -39.21 58.32 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.657 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -81.9 -24.96 35.39 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.07 -57.71 10.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.668 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.86 -46.45 71.69 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.889 0.329 . . . . 0.0 111.889 -178.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -53.83 -28.17 34.08 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.153 0.502 . . . . 0.0 110.835 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.107 HD21 HG22 ' A' ' 57' ' ' VAL . 8.7 tp -72.03 -41.78 67.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.388 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -58.18 9.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.538 -179.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt -52.96 -28.54 24.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.351 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.414 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.2 OUTLIER -69.15 -29.89 68.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.103 -179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.501 HG21 ' CG ' ' A' ' 8' ' ' GLU . 8.0 mt -74.47 -31.76 28.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.872 0.368 . . . . 0.0 110.671 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -68.83 -31.95 71.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.534 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.8 OUTLIER -75.26 -29.65 60.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.432 179.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.559 HD22 HG22 ' A' ' 50' ' ' VAL . 6.1 mt -59.95 170.84 1.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.969 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.87 -72.86 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.548 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 175.16 42.0 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.544 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -106.35 -124.39 5.29 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.501 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -108.47 -29.43 4.2 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.406 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -61.86 -18.94 61.91 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.63 0.252 . . . . 0.0 111.117 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.559 HG22 HD22 ' A' ' 44' ' ' LEU . 21.2 t -51.53 -28.04 8.09 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.796 0.332 . . . . 0.0 111.454 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.74 -29.46 62.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.979 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.1 ttmm -63.28 -57.17 11.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.978 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.488 ' O ' HG23 ' A' ' 57' ' ' VAL . 34.5 t -61.12 -29.72 46.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.16 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -63.21 -32.26 73.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.703 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -79.06 -27.67 43.09 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.895 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -69.27 -28.54 66.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.379 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.107 HG22 HD21 ' A' ' 37' ' ' LEU . 7.2 t -83.22 -25.87 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.116 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.3 mttt -75.23 -28.61 59.98 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.427 -179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.3 -37.85 56.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.676 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.884 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.6 tt -76.93 -25.78 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.118 -0.233 . . . . 0.0 111.439 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -68.36 -56.08 9.76 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.988 0.423 . . . . 0.0 110.28 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -62.25 -26.78 68.58 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.776 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.852 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -60.27 -47.57 85.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.019 -179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.733 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.4 mt -66.37 -24.01 32.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.111 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -63.13 -33.99 76.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.986 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -65.35 -65.35 0.69 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.717 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.864 HD13 HD11 ' A' ' 21' ' ' LEU . 3.3 pp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.2 -0.905 . . . . 0.0 111.085 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.677 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.6 m -69.28 101.97 1.62 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.867 0.365 . . . . 0.0 110.849 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -123.65 -43.66 2.14 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.882 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.46 -38.5 46.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.143 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.3 tmtm? -57.47 -28.44 63.38 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.812 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 9' ' ' GLU . . . -78.71 -25.09 44.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.186 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.48 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -71.79 -33.53 68.64 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.496 -179.465 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -83.06 -32.82 26.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.737 0.303 . . . . 0.0 111.404 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 12' ' ' LYS . 2.3 pp20? -76.2 -19.16 58.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.199 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.87 -46.97 14.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.199 -0.455 . . . . 0.0 112.009 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.64 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.9 t -72.51 -29.51 31.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 9' ' ' GLU . 18.1 ptpt -63.11 -35.42 80.2 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.934 0.397 . . . . 0.0 110.358 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.5 -23.76 37.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.496 0.665 . . . . 0.0 109.572 178.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.696 HD21 HD23 ' A' ' 60' ' ' LEU . 2.4 tt -67.4 -25.22 65.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.004 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.419 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 26.9 tt0 -77.2 -48.47 17.52 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.247 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.38 -25.88 10.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.188 -179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -76.06 -45.2 35.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.342 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.633 HG22 HD13 ' A' ' 64' ' ' ILE . 2.3 t -75.77 -51.04 21.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.458 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 16.3 mttt -52.2 -30.43 27.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.26 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.0 -11.45 35.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.287 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.828 HD11 HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -72.34 -70.06 0.36 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.028 -179.862 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.13 -102.61 0.34 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.508 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 159.26 122.2 0.65 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.518 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -164.74 28.67 0.21 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.798 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 134.56 -103.48 0.48 Allowed Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.836 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.909 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -51.44 -27.91 11.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.821 0.343 . . . . 0.0 111.289 -179.865 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.419 ' HA ' HD12 ' A' ' 30' ' ' LEU . 59.9 mt -64.59 -29.82 48.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.167 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -59.75 -56.02 26.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.338 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.42 -36.72 71.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.849 0.357 . . . . 0.0 111.282 -179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.962 HD23 ' HG ' ' A' ' 60' ' ' LEU . 7.1 mt -67.1 -21.86 65.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.643 -179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -78.54 -59.1 2.92 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 -178.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ttmt -51.89 -59.09 4.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.816 0.341 . . . . 0.0 111.914 -178.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.451 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -59.92 -24.99 64.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.698 -179.458 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.03 -57.75 11.28 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -67.25 -55.47 13.86 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.561 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.8 OUTLIER -47.98 -28.27 2.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.077 0.465 . . . . 0.0 111.18 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.036 HD21 HG22 ' A' ' 57' ' ' VAL . 10.8 tp -70.51 -41.33 72.75 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.342 -179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.05 -58.27 9.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.548 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 10.8 ptmt -52.46 -27.98 18.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.242 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -71.07 -25.82 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.053 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.7 mt -74.07 -31.85 31.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.862 0.363 . . . . 0.0 110.67 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -67.95 -33.56 74.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.335 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.455 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -74.66 -28.59 60.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.737 179.612 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.457 HD11 ' HB ' ' A' ' 53' ' ' VAL . 7.8 mt -58.66 173.23 0.43 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.108 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -129.72 -81.96 0.28 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.558 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -151.79 -43.73 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.523 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -144.29 149.14 21.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.597 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.1 -74.06 0.26 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.524 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -95.03 -23.3 17.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.728 0.299 . . . . 0.0 111.062 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 p -49.46 -27.19 2.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.691 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -26.06 61.91 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.414 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -77.96 -57.39 3.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.206 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.622 ' O ' HG23 ' A' ' 57' ' ' VAL . 22.3 t -57.5 -25.89 25.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.325 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.5 -38.03 86.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 0.0 110.652 179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -72.03 -27.79 62.94 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.87 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -72.06 -28.7 63.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.438 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.036 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.23 -27.35 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.224 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.56 -28.71 59.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.76 -39.08 52.89 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.939 -178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.962 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -78.14 -24.94 47.16 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.632 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -70.43 -54.27 13.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.985 0.422 . . . . 0.0 110.205 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -64.03 -26.85 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.635 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.917 ' HB3' HD21 ' A' ' 30' ' ' LEU . 8.6 mm-40 -59.37 -57.7 11.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.955 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.834 ' CG1' HD22 ' A' ' 30' ' ' LEU . 29.6 mt -56.14 -25.6 20.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.24 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.83 -28.09 65.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.006 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.2 mmmm -71.82 -37.45 70.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.017 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.909 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.953 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.604 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.175 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.75 -30.83 6.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.771 0.319 . . . . 0.0 110.983 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -59.88 -64.55 0.91 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.038 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.78 HG22 HG21 ' A' ' 50' ' ' VAL . 21.3 t -72.78 -42.32 61.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.347 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.34 -31.64 63.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.937 0.399 . . . . 0.0 110.963 -179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.408 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -83.17 -25.77 31.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.253 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.47 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -63.24 -34.71 78.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.213 -179.748 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -68.08 -34.14 75.85 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.295 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 1.5 pt-20 -77.06 -19.79 56.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.4 -0.363 . . . . 0.0 111.409 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -42.74 67.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.346 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.442 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.1 t -78.4 -29.31 14.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -35.6 81.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.043 179.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -23.9 37.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.539 0.685 . . . . 0.0 109.59 178.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.596 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -66.99 -25.33 66.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.905 179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -78.13 -50.7 11.5 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.091 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -49.42 -27.46 4.15 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.135 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -76.04 -40.54 53.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.907 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.669 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 16.0 t -78.32 -55.3 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.115 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -55.2 -22.08 16.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.167 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.64 -16.09 27.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.408 179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.581 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp -102.84 158.54 16.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.89 0.376 . . . . 0.0 110.817 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.504 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -133.11 171.79 21.68 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.597 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.47 -134.78 5.65 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.427 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.581 ' N ' HD12 ' A' ' 27' ' ' ILE . . . -179.21 153.52 12.49 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.527 179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.14 -103.8 2.86 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.568 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -27.76 64.58 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.813 0.339 . . . . 0.0 111.018 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.581 HD12 ' N ' ' A' ' 24' ' ' GLY . 49.4 mt -68.06 -29.8 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.219 -179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -62.51 -56.12 21.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.178 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.57 -29.51 68.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.861 0.362 . . . . 0.0 110.837 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.001 HD21 ' HB3' ' A' ' 63' ' ' GLU . 9.5 mt -72.08 -22.28 61.38 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.325 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -78.61 -59.16 2.89 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.47 -58.87 5.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.794 0.331 . . . . 0.0 111.838 -179.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.744 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.5 ttpm? -60.37 -25.05 65.57 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.75 -179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.38 -57.57 11.74 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -178.639 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -69.36 -55.44 10.4 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.546 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -48.01 -28.62 2.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.006 0.431 . . . . 0.0 111.141 -179.74 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.109 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.02 -38.24 75.86 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.165 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -58.02 8.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.375 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 ptmt -50.25 -31.78 14.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.378 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.407 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 38.2 tttp -66.76 -25.98 66.75 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.888 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.2 mt -74.13 -32.41 32.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.9 0.381 . . . . 0.0 110.625 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -67.35 -36.34 81.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.273 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -71.02 -29.78 65.82 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.483 179.738 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.671 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.1 mt -61.76 166.35 4.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.93 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.72 -96.25 0.22 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.53 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -94.55 -141.48 11.51 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.496 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -87.53 157.06 28.54 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.599 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 124.75 -68.44 0.5 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.517 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.427 ' HB3' HD21 ' A' ' 44' ' ' LEU . 7.8 tt0 -95.1 -22.72 17.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.794 0.331 . . . . 0.0 111.005 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.78 HG21 HG22 ' A' ' 4' ' ' VAL . 14.3 p -50.1 -28.33 4.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.53 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.62 -31.55 67.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.068 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.7 tttt -66.42 -57.25 7.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.918 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.671 ' CG2' HD11 ' A' ' 44' ' ' LEU . 18.0 t -58.99 -25.9 31.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.126 179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -38.36 89.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.94 0.4 . . . . 0.0 110.496 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -71.71 -27.88 63.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.638 179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -69.75 -28.94 66.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.928 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.109 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.49 -25.45 7.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.046 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -74.58 -28.38 60.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.437 -179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.7 tmtt? -75.61 -43.44 48.0 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.503 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.937 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -72.51 -25.04 61.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.59 -179.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -69.76 -56.14 7.97 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.936 0.398 . . . . 0.0 110.557 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -59.49 -26.94 65.7 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.807 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 1.001 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.32 -48.41 78.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.943 -179.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.671 ' CG1' HD22 ' A' ' 30' ' ' LEU . 15.6 mt -65.75 -24.16 33.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.861 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -35.33 76.12 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.989 -179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -62.68 -58.54 7.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.72 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.568 HD11 HG23 ' A' ' 64' ' ' ILE . 3.3 pp . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.201 -0.904 . . . . 0.0 110.929 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.669 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.531 -0.228 . . . . 0.0 112.531 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.4 m -153.26 110.28 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.835 0.35 . . . . 0.0 110.884 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 mtm180 -176.5 -40.4 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.874 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.2 p -73.83 -28.33 24.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.173 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -35.78 66.51 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.854 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.48 -25.91 54.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.96 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.917 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -66.64 -27.94 68.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.521 ' HG3' HG21 ' A' ' 41' ' ' ILE . 58.1 mt-10 -78.68 -32.57 47.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.639 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.95 -20.47 56.1 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.457 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 tttt -74.81 -55.04 6.24 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.897 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.705 HG22 HG13 ' A' ' 57' ' ' VAL . 12.1 t -63.91 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.267 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.5 tttt -59.23 -36.84 76.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.438 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.407 ' HB1' ' OE2' ' A' ' 16' ' ' GLU . . . -78.95 -23.89 44.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.531 0.682 . . . . 0.0 109.414 178.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.599 HD21 HD23 ' A' ' 60' ' ' LEU . 2.3 tt -66.85 -24.99 66.2 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.856 -1.066 . . . . 0.0 110.86 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.428 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 34.3 tt0 -74.19 -49.77 22.11 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.63 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.407 ' OE2' ' HB1' ' A' ' 13' ' ' ALA . 1.1 pt-20 -50.71 -26.02 5.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.757 0.313 . . . . 0.0 111.341 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -75.11 -43.91 50.16 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.173 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.647 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.0 t -77.94 -56.26 8.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.334 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.428 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 22.2 mttt -51.82 -24.11 5.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.301 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.52 -18.81 28.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.142 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.585 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.3 pp -102.64 159.34 15.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.808 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.519 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -145.84 145.29 14.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.672 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 173.26 -128.17 1.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.428 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -173.76 155.35 21.83 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.461 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 92.19 -103.59 3.07 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.473 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.556 ' HG3' ' HA ' ' A' ' 67' ' ' LEU . 0.2 OUTLIER -56.56 -27.63 58.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.908 0.385 . . . . 0.0 111.104 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.409 HD13 ' CD1' ' A' ' 21' ' ' LEU . 61.4 mt -74.19 -29.69 25.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.502 -179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -56.15 15.23 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.759 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -61.19 -37.58 83.45 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.795 0.331 . . . . 0.0 111.163 -179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.625 HD21 ' HB3' ' A' ' 63' ' ' GLU . 71.5 mt -67.54 -21.41 65.47 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.801 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -78.03 -59.29 2.84 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -53.59 -34.8 59.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.748 0.308 . . . . 0.0 111.777 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.46 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.02 -24.78 35.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.823 -179.404 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.96 -58.0 8.06 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.055 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.03 -46.4 68.03 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.876 -178.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -55.05 -28.17 50.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.057 0.456 . . . . 0.0 110.789 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.981 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.33 -42.44 75.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.328 -179.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.73 -58.17 9.72 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.4 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.2 ptmt -49.97 -32.8 15.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.444 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -66.46 -26.84 67.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.521 HG21 ' HG3' ' A' ' 8' ' ' GLU . 8.4 mt -74.81 -32.39 28.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.888 0.375 . . . . 0.0 110.569 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -67.65 -33.18 74.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.413 179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.462 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -74.42 -29.79 61.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.509 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.581 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.8 mt -60.18 -175.32 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.971 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.22 -56.92 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.466 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 152.81 46.49 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.665 -0.778 . . . . 0.0 112.529 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.47 151.06 5.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.523 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.52 -80.2 1.4 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.467 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -95.14 -17.58 21.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.699 0.285 . . . . 0.0 111.027 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.7 p -50.74 -29.56 7.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.482 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.4 pttp -66.17 -31.0 71.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.029 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.2 tptp -66.33 -57.25 7.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.875 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.588 ' O ' HG23 ' A' ' 57' ' ' VAL . 44.8 t -55.49 -26.01 18.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.202 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -64.93 -36.58 84.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.933 0.397 . . . . 0.0 110.57 179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -73.79 -27.84 61.35 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.723 179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -69.53 -28.69 66.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.983 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.981 HG22 HD21 ' A' ' 37' ' ' LEU . 10.2 t -82.76 -25.71 8.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.115 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.35 -28.38 59.55 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.597 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.08 -41.19 62.08 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.12 -26.17 47.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -178.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -71.54 -42.22 68.17 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.962 0.41 . . . . 0.0 110.735 -179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 65' ' ' LYS . 4.4 tt0 -74.26 -26.38 60.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.171 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.625 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.5 OUTLIER -64.38 -59.2 4.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.405 -179.531 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.735 ' HA ' HD12 ' A' ' 67' ' ' LEU . 37.9 mt -51.29 -26.58 5.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.044 -179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 62' ' ' GLU . 2.4 mptp? -52.9 -38.72 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.8 0.333 . . . . 0.0 111.043 -179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.9 mmmt -95.6 -67.36 0.86 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.408 179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.735 HD12 ' HA ' ' A' ' 64' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.947 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.647 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.218 0 N-CA-C 112.474 -0.251 . . . . 0.0 112.474 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.1 p -110.99 111.79 23.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.855 0.36 . . . . 0.0 110.934 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -115.23 -66.79 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.878 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.3 t -81.15 -41.3 19.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.016 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.25 -32.97 62.75 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.581 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -73.05 -25.65 61.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.875 179.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.55 -33.34 72.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.27 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -74.48 -30.4 61.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.496 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.507 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 9.4 pt-20 -77.01 -24.77 52.13 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.796 0.331 . . . . 0.0 111.021 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.52 -52.5 38.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.813 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.626 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.3 t -67.06 -29.21 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.351 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -37.06 75.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.711 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.78 -24.48 38.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.487 0.66 . . . . 0.0 109.56 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.585 HD21 HD23 ' A' ' 60' ' ' LEU . 1.9 tt -64.99 -24.94 67.66 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.941 179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.422 ' HG2' ' HG3' ' A' ' 19' ' ' LYS . 0.6 OUTLIER -77.38 -55.34 5.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.607 -179.122 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -46.8 -27.72 1.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.513 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -76.1 -40.5 52.8 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.313 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.679 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 13.1 t -78.19 -45.48 26.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.484 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.422 ' HG3' ' HG2' ' A' ' 15' ' ' GLU . 0.5 OUTLIER -49.22 -29.91 6.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.495 -179.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.55 -13.23 37.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.472 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.743 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -69.12 -69.7 0.32 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.978 -179.952 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 122.35 -83.04 0.35 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.419 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 176.02 147.01 6.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.43 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.679 ' N ' HD12 ' A' ' 27' ' ' ILE . . . -164.14 32.41 0.26 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.518 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.11 -78.53 1.93 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.519 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.591 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.96 -28.13 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.887 0.375 . . . . 0.0 110.771 -179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.744 HG12 HD22 ' A' ' 67' ' ' LEU . 12.5 mt -67.78 -29.72 46.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.243 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.48 -52.78 60.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.108 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -57.64 -30.39 65.35 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.909 0.385 . . . . 0.0 110.923 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.979 HD23 ' HG ' ' A' ' 60' ' ' LEU . 1.0 OUTLIER -71.5 -21.86 61.87 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.306 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.2 tttm -78.09 -59.34 2.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.998 -179.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.35 -45.75 69.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.823 0.344 . . . . 0.0 111.809 -179.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.576 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -71.55 -24.94 62.03 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.809 -179.518 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.93 -57.96 8.99 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.631 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 -47.07 66.87 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -178.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.07 -28.09 49.78 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.096 0.474 . . . . 0.0 110.844 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.046 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -72.92 -39.0 66.66 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.431 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -53.08 62.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.451 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -27.99 68.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.384 -179.496 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 6.5 tptm -67.09 -27.14 67.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.281 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.47 -33.59 23.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.881 0.372 . . . . 0.0 110.666 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -66.45 -31.46 72.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.21 179.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.476 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.6 OUTLIER -77.11 -29.41 54.81 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.441 179.644 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.701 HD11 ' CG2' ' A' ' 53' ' ' VAL . 23.6 mt -60.93 175.44 0.5 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.002 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -125.28 -95.82 1.05 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.403 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -157.12 25.75 0.48 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.519 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 163.47 160.84 11.89 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.499 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.09 -92.58 1.65 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.538 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -85.17 -21.19 29.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.705 0.288 . . . . 0.0 111.201 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.497 HG13 HD13 ' A' ' 44' ' ' LEU . 29.3 t -53.34 -27.89 14.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.396 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.31 -28.54 67.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.044 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.25 -57.17 4.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.936 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.701 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.5 t -52.47 -27.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.481 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -63.27 -30.99 72.03 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.983 0.421 . . . . 0.0 110.687 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -80.97 -27.83 35.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.831 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -67.95 -28.72 67.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.189 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.046 HG22 HD21 ' A' ' 37' ' ' LEU . 21.2 t -81.05 -25.84 10.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.93 0.395 . . . . 0.0 110.969 -179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.01 -28.42 60.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.332 -179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.25 -37.15 61.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.646 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.979 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.0 tt -76.08 -28.67 57.67 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 121.087 -0.245 . . . . 0.0 111.393 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.5 -56.13 12.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.917 0.389 . . . . 0.0 110.652 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -62.26 -26.79 68.59 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.841 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.854 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -61.82 -43.19 99.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.028 -179.84 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.893 HG12 HD22 ' A' ' 30' ' ' LEU . 17.5 mt -65.72 -24.53 34.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.208 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.1 71.59 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.888 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.73 -61.55 2.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.831 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.744 HD22 HG12 ' A' ' 27' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.305 -0.855 . . . . 0.0 111.073 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.679 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t -134.05 119.39 18.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.929 0.395 . . . . 0.0 110.861 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.1 ttm180 -176.23 -60.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.898 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.3 p -67.17 -27.82 40.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.172 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt -54.76 -34.78 63.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.89 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.46 -25.86 41.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.0 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.035 HD21 HG21 ' A' ' 57' ' ' VAL . 0.8 OUTLIER -62.03 -30.21 70.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.119 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -72.44 -33.11 66.83 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.381 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -77.34 -19.6 56.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.534 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.12 -43.2 24.55 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.953 0.353 . . . . 0.0 111.953 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.633 HG22 ' CG1' ' A' ' 57' ' ' VAL . 17.6 t -76.91 -29.39 17.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -63.07 -35.24 79.61 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.973 0.416 . . . . 0.0 110.283 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.28 -26.76 35.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.606 0.717 . . . . 0.0 109.503 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' HG23 ' A' ' 18' ' ' VAL . 2.7 tt -63.15 -25.46 68.36 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.814 179.324 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.406 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.6 tt0 -76.86 -45.11 29.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.196 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.43 -29.03 22.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.143 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.26 -45.95 30.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.643 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.9 t -70.87 -51.57 34.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.527 -179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -50.33 -31.01 13.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.364 -179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.2 -13.33 38.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.387 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.868 HD22 HD11 ' A' ' 27' ' ' ILE . 0.6 OUTLIER -65.11 -69.07 0.31 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.994 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.546 ' C ' HD13 ' A' ' 27' ' ' ILE . . . 149.59 -124.93 1.88 Allowed Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.468 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.44 ' N ' HD13 ' A' ' 27' ' ' ILE . . . -163.81 165.29 36.87 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.499 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 147.9 -115.41 0.75 Allowed Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.494 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -103.92 -56.01 0.76 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.512 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.452 ' HD2' HD11 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.49 -62.03 2.11 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 0.0 110.875 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.868 HD11 HD22 ' A' ' 21' ' ' LEU . 10.6 mt -51.04 -29.15 7.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.952 -179.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -60.04 -56.35 22.68 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.36 -56.61 19.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.979 0.419 . . . . 0.0 111.365 -179.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.936 HD13 HG12 ' A' ' 64' ' ' ILE . 37.5 mt -53.01 -21.02 3.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.467 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.9 -59.25 2.86 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.91 -39.15 58.64 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.749 ' HD3' HD12 ' A' ' 60' ' ' LEU . 34.7 tttp -80.77 -24.67 38.48 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.282 -0.417 . . . . 0.0 112.12 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.3 -57.77 9.31 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -178.649 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -47.76 66.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.036 -178.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.43 -28.19 42.38 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.064 0.459 . . . . 0.0 110.973 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.014 HD21 HG22 ' A' ' 57' ' ' VAL . 4.9 tp -70.39 -41.71 72.66 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.313 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 12.4 mtmt -58.98 -58.08 10.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.352 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.31 -28.02 26.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.206 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.41 -26.31 63.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.033 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.9 mt -74.22 -32.55 32.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.969 0.414 . . . . 0.0 110.628 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.61 -33.98 76.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.515 179.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.453 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -73.72 -29.26 62.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.646 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.737 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.2 mt -58.96 161.79 4.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.979 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -112.58 -75.13 0.71 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.553 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 168.97 57.51 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.561 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 138.89 144.65 4.64 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.546 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 94.28 -76.28 1.0 Allowed Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.559 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -95.1 -20.04 19.62 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.701 0.286 . . . . 0.0 111.037 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -48.91 -30.64 3.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.447 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -29.9 65.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.917 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -66.71 -57.19 7.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.878 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.737 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.6 t -56.57 -29.51 29.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.141 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.645 ' HA ' HD11 ' A' ' 7' ' ' LEU . 19.6 tt0 -62.25 -33.59 74.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.623 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -76.85 -28.01 55.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.786 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -67.58 -28.82 68.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.965 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.035 HG21 HD21 ' A' ' 7' ' ' LEU . 11.9 t -83.03 -25.48 8.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.998 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -74.11 -28.21 61.24 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.486 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.54 -41.45 54.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.749 HD12 ' HD3' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -76.91 -25.73 53.29 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -178.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.505 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.45 -53.96 14.26 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.991 0.424 . . . . 0.0 110.628 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -64.39 -26.89 68.66 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.185 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.644 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.4 mm-40 -61.9 -59.08 5.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.258 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.936 HG12 HD13 ' A' ' 30' ' ' LEU . 33.5 mt -54.28 -25.45 13.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.667 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -53.0 -38.64 62.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.724 0.297 . . . . 0.0 111.438 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.6 mttp -99.99 -67.18 0.86 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.864 0.364 . . . . 0.0 110.951 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.775 ' CD1' HD11 ' A' ' 21' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.864 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.643 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 m -145.86 -47.48 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.805 0.336 . . . . 0.0 110.922 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.1 ttm180 -161.79 -44.57 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.96 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.6 t -66.36 -33.94 66.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.172 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.7 -30.95 71.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.911 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.528 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -81.91 -25.69 34.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.215 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.72 -35.81 80.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.479 -179.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -72.44 -31.34 65.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.596 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.528 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 4.4 pt-20 -77.25 -21.92 52.97 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.725 0.298 . . . . 0.0 111.378 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.06 -54.98 9.23 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.235 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.568 HG22 HG13 ' A' ' 57' ' ' VAL . 22.7 t -67.76 -29.21 44.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.419 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.9 mtpp -59.5 -36.65 76.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.634 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.03 -23.99 38.21 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.6 0.714 . . . . 0.0 109.541 178.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.567 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.24 -25.23 67.58 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.819 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' HG3' ' HG3' ' A' ' 19' ' ' LYS . 26.9 tt0 -75.84 -46.02 32.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.012 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -53.17 -27.1 19.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.207 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.99 -49.19 18.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.071 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.689 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 18.7 t -70.08 -55.2 15.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.376 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 6.2 mtpt -52.67 -24.53 8.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.492 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.92 -19.12 26.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.029 0.442 . . . . 0.0 110.521 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.897 HD12 HG21 ' A' ' 27' ' ' ILE . 1.6 tm? -78.66 146.92 33.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.248 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.778 ' H ' HD22 ' A' ' 21' ' ' LEU . . . -56.01 -97.02 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.642 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -173.91 -179.91 44.86 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.664 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.22 -160.66 29.02 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.484 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -83.5 -57.89 2.38 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.437 179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -61.41 2.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.014 0.435 . . . . 0.0 110.922 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.897 HG21 HD12 ' A' ' 21' ' ' LEU . 2.0 mp -51.75 -29.46 10.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.911 -179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.22 -56.18 25.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.564 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.08 -32.49 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.985 0.422 . . . . 0.0 110.962 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.933 HD22 ' CG1' ' A' ' 64' ' ' ILE . 2.4 mt -69.2 -21.27 63.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.618 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -77.72 -59.19 2.88 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -54.1 32.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.84 0.352 . . . . 0.0 111.583 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.404 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 9.3 tttp -65.1 -25.07 67.62 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.784 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.5 -57.53 12.35 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -178.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.08 -52.34 43.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.46 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.8 tm-20 -49.49 -28.38 5.32 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.018 0.437 . . . . 0.0 111.106 -179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.03 HD21 HG22 ' A' ' 57' ' ' VAL . 9.7 tp -71.87 -41.89 67.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.58 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -58.29 9.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.707 -179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.6 -33.02 9.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.636 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.442 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 4.5 tttt -67.85 -27.19 66.48 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.165 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.0 mt -76.0 -31.49 21.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.868 0.366 . . . . 0.0 110.752 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -69.69 -31.41 69.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.336 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.6 pt-20 -76.05 -29.6 58.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.529 179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 HG23 ' A' ' 50' ' ' VAL . 8.3 mt -61.18 159.23 12.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.018 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.36 -82.15 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.567 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -89.28 -114.04 1.38 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.518 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -130.04 -170.92 12.82 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.581 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.43 -63.2 0.97 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.487 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -95.05 -24.52 16.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.768 0.318 . . . . 0.0 110.937 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.617 HG23 HD13 ' A' ' 44' ' ' LEU . 14.7 p -54.35 -28.73 18.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.351 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttp -66.06 -32.84 74.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.153 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -69.69 -57.34 5.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.994 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.4 t -52.87 -25.81 9.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.432 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -65.87 -38.06 87.79 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.719 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -72.06 -27.78 62.91 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.84 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -70.84 -29.11 65.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.136 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.03 HG22 HD21 ' A' ' 37' ' ' LEU . 20.8 t -83.28 -25.85 7.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.116 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -75.31 -28.5 59.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.51 -179.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.29 -38.59 55.91 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -178.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.929 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.0 -25.34 47.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.616 0.246 . . . . 0.0 111.627 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.28 -54.18 15.98 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.065 0.459 . . . . 0.0 110.466 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -65.16 -26.84 68.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.923 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.932 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.85 -51.19 70.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.166 -179.746 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.933 ' CG1' HD22 ' A' ' 30' ' ' LEU . 19.4 mt -62.03 -24.64 35.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.114 179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.0 mptt -66.07 -31.87 73.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.969 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 16.6 mttm -66.65 -59.59 3.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.869 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.564 HD21 ' HA ' ' A' ' 64' ' ' ILE . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.964 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.689 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -136.62 -178.6 5.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.838 0.351 . . . . 0.0 110.85 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.96 -40.94 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.913 179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -64.44 -27.01 41.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.24 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -53.53 -38.84 64.16 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.868 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -69.6 -25.67 64.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.1 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.659 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -68.77 -29.18 67.5 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.168 -179.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -78.73 -39.98 34.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.323 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -19.97 63.11 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.381 -179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 -53.76 14.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.192 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.579 HG22 ' CG1' ' A' ' 57' ' ' VAL . 31.6 t -64.31 -29.31 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.41 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -37.1 75.09 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.729 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.85 -23.93 41.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.511 0.672 . . . . 0.0 109.517 178.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.677 HD21 HD23 ' A' ' 60' ' ' LEU . 2.2 tt -65.22 -25.28 67.62 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.7 -1.136 . . . . 0.0 110.707 179.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.409 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 41.9 tt0 -79.09 -47.4 16.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -51.36 -30.64 19.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.899 0.381 . . . . 0.0 111.082 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.4 tttm -76.15 -38.04 57.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.075 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.675 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 20.0 t -78.12 -56.26 8.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.399 -179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.7 mtpp -52.74 -24.62 9.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.243 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.97 -18.75 26.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.98 179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.629 HD11 HG12 ' A' ' 27' ' ' ILE . 1.2 pp -103.29 159.24 15.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.751 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.551 ' HA2' HD13 ' A' ' 27' ' ' ILE . . . -171.31 152.32 17.74 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.641 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 114.87 95.52 2.06 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.539 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 131.87 157.12 8.58 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.548 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -76.89 -27.54 60.37 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.474 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.626 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.23 -37.27 72.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.864 0.364 . . . . 0.0 110.913 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.629 HG12 HD11 ' A' ' 21' ' ' LEU . 19.7 mt -63.41 -29.73 47.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.867 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -63.92 -56.18 17.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.628 -179.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -27.09 67.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.721 0.296 . . . . 0.0 111.241 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 63' ' ' GLU . 96.5 mt -76.83 -21.54 54.89 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.552 -179.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -78.33 -59.35 2.82 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -53.34 -36.24 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.799 0.333 . . . . 0.0 111.727 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.77 35.1 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.842 -179.265 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.8 -57.71 9.06 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -178.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -44.94 72.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.885 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 52.9 tt0 -55.34 -28.04 51.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.161 0.505 . . . . 0.0 110.776 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 6.1 tp -70.97 -42.2 70.02 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.337 -179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -57.96 -58.19 9.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.537 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.414 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 7.1 pttt -51.69 -28.36 14.57 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.429 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.5 tttt -70.74 -26.9 63.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.013 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.546 ' HA ' HD12 ' A' ' 44' ' ' LEU . 6.9 mt -77.73 -29.56 16.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.867 0.365 . . . . 0.0 110.749 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.1 -38.98 89.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.423 179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.434 ' HG2' ' N ' ' A' ' 44' ' ' LEU . 3.7 pt-20 -68.17 -35.21 77.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.347 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.858 HD11 HG21 ' A' ' 53' ' ' VAL . 7.0 mt -54.08 179.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.024 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -145.69 -67.15 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.486 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.483 ' HA2' HG21 ' A' ' 50' ' ' VAL . . . 143.52 93.27 0.17 Allowed Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.418 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.62 -37.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.649 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -169.89 -39.83 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.769 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.598 ' O ' ' HG2' ' A' ' 52' ' ' LYS . 4.8 tt0 -65.76 -14.68 61.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.62 0.247 . . . . 0.0 111.533 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.483 HG21 ' HA2' ' A' ' 46' ' ' GLY . 21.5 t -64.78 -14.69 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.706 0.288 . . . . 0.0 111.234 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -52.92 11.43 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.598 ' HG2' ' O ' ' A' ' 49' ' ' GLU . 0.7 OUTLIER -54.81 -57.2 12.51 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.858 HG21 HD11 ' A' ' 44' ' ' LEU . 16.5 t -55.66 -31.31 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-O 120.806 0.336 . . . . 0.0 111.246 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.659 ' HG2' HD11 ' A' ' 7' ' ' LEU . 2.1 tm-20 -61.95 -32.7 73.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.746 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.9 tt0 -77.37 -27.74 52.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.841 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -68.02 -29.94 69.06 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 14.5 t -83.31 -25.56 7.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.179 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -28.18 61.05 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.376 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.72 -37.83 59.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.757 -179.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.677 HD23 HD21 ' A' ' 14' ' ' LEU . 1.1 tt -78.09 -25.7 47.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.759 -179.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -70.29 -55.53 8.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.03 0.443 . . . . 0.0 110.496 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -63.28 -26.89 68.99 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.919 179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.865 ' HB3' HD21 ' A' ' 30' ' ' LEU . 5.1 mt-10 -62.58 -49.35 75.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.464 -179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.793 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -58.21 -27.75 33.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.075 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -67.35 -30.35 70.14 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.898 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -69.23 -53.62 18.97 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.843 HD21 HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.303 -0.856 . . . . 0.0 110.947 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.675 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.1 m -151.6 94.53 2.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.829 0.347 . . . . 0.0 110.901 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -111.35 -45.82 3.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 27.7 t -75.96 -34.41 27.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.044 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -33.57 70.07 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.002 0.429 . . . . 0.0 110.618 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.4 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -72.49 -25.39 61.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.074 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.51 -38.21 74.27 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.596 -179.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -74.53 -33.43 62.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.548 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.4 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -76.94 -19.72 57.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.21 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -42.79 47.23 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.143 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 34.9 t -74.12 -29.42 25.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.379 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.9 tttt -62.08 -36.02 80.41 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.347 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.22 -24.49 37.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.463 0.649 . . . . 0.0 109.54 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.55 HD21 HD23 ' A' ' 60' ' ' LEU . 1.4 tt -65.74 -25.24 67.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.745 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.433 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 35.6 tt0 -74.17 -40.31 62.65 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.167 -179.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -53.63 -28.61 33.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.196 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 2.9 tptt -76.06 -43.8 42.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.278 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.754 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.4 t -73.97 -52.56 20.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.373 -179.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.433 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.3 mttm -49.12 -31.71 8.59 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.775 0.321 . . . . 0.0 111.577 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.14 -12.28 61.4 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.489 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.828 HD22 ' N ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -62.89 174.8 0.98 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.297 -179.843 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.828 ' N ' HD22 ' A' ' 21' ' ' LEU . . . -134.27 -59.67 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.459 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -150.41 135.25 5.13 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.514 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 176.32 -167.81 39.6 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.636 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -113.37 -66.52 0.47 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.5 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.26 -27.8 4.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.72 0.295 . . . . 0.0 111.229 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.697 HG21 ' HG ' ' A' ' 21' ' ' LEU . 55.6 mt -65.01 -29.95 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.441 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -62.22 -56.06 22.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -58.84 -27.0 64.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.894 0.378 . . . . 0.0 110.836 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.985 HD21 ' HB3' ' A' ' 63' ' ' GLU . 4.9 mt -73.71 -23.4 59.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.292 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -78.32 -59.43 2.78 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -36.98 45.0 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.671 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -82.06 -24.93 35.01 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.353 -0.385 . . . . 0.0 112.022 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.43 -57.85 8.1 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -178.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -43.51 73.8 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 -178.594 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -58.29 -28.2 64.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.029 0.442 . . . . 0.0 110.9 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.139 HD21 HG22 ' A' ' 57' ' ' VAL . 6.4 tp -69.13 -48.3 62.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.458 -179.503 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.43 -58.25 8.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.532 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -29.03 30.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.399 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.406 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 28.4 tttm -70.04 -26.25 63.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.123 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.2 mt -76.76 -32.34 20.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.96 0.409 . . . . 0.0 110.712 179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -69.0 -32.57 72.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.443 179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.479 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.32 -29.97 60.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.518 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.73 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.2 mt -55.45 160.82 2.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.963 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.51 -101.03 2.57 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.511 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.463 ' O ' HG21 ' A' ' 50' ' ' VAL . . . -128.15 -47.22 0.18 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.63 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -144.88 176.44 23.95 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.498 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.37 -81.4 1.38 Allowed Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.505 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -73.14 -16.83 61.44 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.632 0.253 . . . . 0.0 111.3 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.463 HG21 ' O ' ' A' ' 46' ' ' GLY . 22.1 t -56.0 -21.87 12.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.609 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 7.9 ttmt -75.61 -25.95 57.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.186 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -78.01 -57.31 3.86 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.108 -179.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.73 ' CG2' HD11 ' A' ' 44' ' ' LEU . 20.8 t -57.45 -29.8 34.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.369 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.37 -38.57 90.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.885 0.374 . . . . 0.0 110.649 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -71.69 -27.68 63.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.862 179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -69.59 -29.28 66.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.307 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.139 HG22 HD21 ' A' ' 37' ' ' LEU . 15.4 t -83.21 -25.77 7.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.919 0.39 . . . . 0.0 111.187 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.84 -28.31 60.63 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.275 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.8 tmmt? -75.16 -41.01 59.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.76 -179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.925 ' HG ' HD23 ' A' ' 30' ' ' LEU . 2.1 tt -73.59 -27.64 61.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.642 -179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.58 -56.04 11.03 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.885 0.374 . . . . 0.0 110.789 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.428 ' HA ' ' HG2' ' A' ' 65' ' ' LYS . 6.3 tt0 -61.11 -26.93 68.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.199 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.985 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.91 -49.38 75.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.389 -179.485 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.581 ' CG1' HD22 ' A' ' 30' ' ' LEU . 16.8 mt -63.82 -24.46 35.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.755 0.312 . . . . 0.0 111.313 -179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 62' ' ' GLU . 49.7 mmtt -55.99 -37.66 69.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.131 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.78 -54.24 24.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.699 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.516 HD12 ' OXT' ' A' ' 67' ' ' LEU . 1.8 pp . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.076 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.618 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.179 0 N-CA-C 112.483 -0.247 . . . . 0.0 112.483 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.4 m -68.48 132.51 47.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.937 0.398 . . . . 0.0 110.865 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.1 ttm-85 -122.71 -55.82 1.8 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.849 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.3 t -82.98 -29.82 8.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.264 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.69 -35.05 70.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.903 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.18 -25.77 39.59 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.187 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -64.97 -28.49 69.55 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.007 -179.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -73.33 -33.35 65.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.078 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -77.2 -20.01 55.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.302 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.56 -45.63 65.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.255 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.489 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.9 t -75.91 -29.42 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.475 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.67 -35.86 81.03 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.979 0.419 . . . . 0.0 110.173 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -24.06 37.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.515 0.674 . . . . 0.0 109.467 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.613 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.5 OUTLIER -66.05 -25.15 66.92 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.915 179.426 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -75.85 -56.13 4.97 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.365 -179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -47.04 -29.52 2.18 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.366 -179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -76.04 -39.53 55.39 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.003 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.659 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 25.0 t -78.09 -51.57 17.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.326 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.6 mttt -51.21 -29.87 15.49 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.408 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.93 -11.78 35.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.327 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.581 HD11 HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -68.37 -69.75 0.31 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.868 0.366 . . . . 0.0 110.937 -179.891 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 160.63 -120.71 0.97 Allowed Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.445 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 172.32 157.59 14.53 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.732 -0.746 . . . . 0.0 112.579 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 97.52 95.19 1.92 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.504 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 115.31 -136.68 13.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.508 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.924 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -56.88 -27.77 60.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.839 0.352 . . . . 0.0 111.02 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.3 mt -70.14 -29.66 40.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.282 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.04 -56.09 22.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.295 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.23 -32.75 68.63 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.963 0.411 . . . . 0.0 111.053 -179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.91 HD23 ' HG ' ' A' ' 60' ' ' LEU . 9.3 mt -71.16 -21.62 62.15 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.612 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -78.53 -58.97 2.97 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -178.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.08 -59.04 4.6 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.095 0.405 . . . . 0.0 112.095 -178.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.641 ' NZ ' HD12 ' A' ' 60' ' ' LEU . 4.1 ttpm? -61.22 -25.06 66.8 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.936 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.47 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.21 -57.63 11.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -178.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.506 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.34 -55.41 16.08 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.511 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.506 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 33.7 tt0 -48.47 -28.51 3.36 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.983 0.421 . . . . 0.0 111.391 -179.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.1 HD21 HG22 ' A' ' 57' ' ' VAL . 10.9 tp -70.32 -42.63 71.69 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.805 -179.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -58.49 6.97 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.727 0.298 . . . . 0.0 111.739 -179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -51.23 -27.94 10.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.513 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.43 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 7.9 ttpt -70.73 -28.22 64.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.093 -179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 8.2 mt -75.14 -32.76 27.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.875 0.369 . . . . 0.0 110.659 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.09 -33.38 74.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.344 179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.4 pt-20 -73.98 -29.73 62.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.6 HD13 HG22 ' A' ' 50' ' ' VAL . 9.8 mt -62.25 162.69 9.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.009 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -128.31 -88.35 0.58 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.505 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -88.32 -100.84 0.94 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.519 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -131.34 -141.46 4.8 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.498 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 68.92 -81.32 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.489 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.425 ' CD ' HD21 ' A' ' 44' ' ' LEU . 3.4 tt0 -68.53 -26.12 65.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.779 0.324 . . . . 0.0 111.002 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.6 HG22 HD13 ' A' ' 44' ' ' LEU . 21.7 t -59.28 -19.66 16.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.519 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.2 ttpm? -70.65 -35.06 72.68 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.887 0.375 . . . . 0.0 111.022 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 31.0 tttt -73.56 -57.15 4.2 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.945 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.545 ' O ' HG23 ' A' ' 57' ' ' VAL . 38.7 t -53.14 -25.96 10.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.309 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -35.83 82.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.609 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -74.54 -27.88 60.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.73 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -70.12 -28.73 65.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.115 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.1 HG22 HD21 ' A' ' 37' ' ' LEU . 15.9 t -83.1 -25.83 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.125 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -75.27 -28.42 59.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.533 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 tmtt? -76.06 -38.56 56.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.91 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -78.18 -25.09 47.0 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.598 -179.44 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.64 -54.18 15.17 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.001 0.429 . . . . 0.0 110.273 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -64.76 -26.83 68.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.651 179.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.903 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.8 OUTLIER -58.78 -56.2 25.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.9 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.699 ' CG1' HD22 ' A' ' 30' ' ' LEU . 23.5 mt -59.15 -24.5 27.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.187 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -31.54 72.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.88 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 mttm -64.62 -46.14 83.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.896 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.924 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.901 -179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.659 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 112.584 -0.206 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 61.14 44.17 10.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.851 0.357 . . . . 0.0 110.821 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -101.68 -54.13 2.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.961 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.9 p -65.34 -29.2 46.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.178 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.6 mtmt -57.43 -35.66 70.36 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.831 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.72 -25.87 54.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.157 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.495 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -63.85 -27.07 68.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.993 179.991 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.402 ' HG3' HG21 ' A' ' 41' ' ' ILE . 53.2 mt-10 -75.12 -32.54 61.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.243 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -77.19 -20.68 55.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.245 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -68.86 -51.0 45.03 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.016 -179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.682 HG22 ' CG1' ' A' ' 57' ' ' VAL . 14.7 t -71.57 -29.14 33.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.492 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 6.9 ttpt -60.86 -36.38 79.0 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.441 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.1 -24.67 37.55 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.409 0.623 . . . . 0.0 109.559 178.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.49 -25.4 67.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.892 179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.7 tt0 -77.71 -47.76 18.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.25 -29.57 3.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.319 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.7 tppt? -76.14 -40.01 53.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.089 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.676 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 10.1 t -78.01 -59.53 2.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.997 0.427 . . . . 0.0 111.235 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -51.49 -22.82 3.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -87.99 -18.28 29.39 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.379 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.834 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp -99.88 173.0 6.88 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.511 -0.313 . . . . 0.0 110.911 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.771 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -144.66 150.42 22.55 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.517 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 150.89 -169.09 30.66 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.54 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -143.54 168.19 26.36 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.516 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.81 -98.42 2.28 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.569 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 26' ' ' ARG . 0.0 OUTLIER -54.67 -62.1 1.88 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.111 0.481 . . . . 0.0 110.842 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.834 HG21 HD11 ' A' ' 21' ' ' LEU . 4.9 mt -55.42 -29.55 24.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.803 -179.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -56.24 20.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.666 -179.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -59.16 -41.12 87.62 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.991 0.424 . . . . 0.0 110.853 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.932 HD23 ' HG ' ' A' ' 60' ' ' LEU . 2.9 mt -59.41 -21.13 59.51 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.702 -179.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.4 -59.0 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.76 -59.05 4.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.886 0.374 . . . . 0.0 111.691 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.512 ' HZ3' HD12 ' A' ' 60' ' ' LEU . 1.3 ttpt -61.21 -24.86 66.65 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.845 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.38 -57.5 12.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -178.908 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.485 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.34 -54.63 16.06 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -178.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.485 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.52 -28.3 3.28 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.02 0.438 . . . . 0.0 111.238 -179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.041 HD21 HG22 ' A' ' 57' ' ' VAL . 9.0 tp -69.13 -41.48 77.28 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.468 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.73 -58.26 8.1 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.44 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -52.02 -27.93 15.29 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.409 -179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -68.25 -29.07 67.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.047 -179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.402 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.7 mt -75.2 -32.59 26.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.891 0.377 . . . . 0.0 110.602 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -67.7 -31.3 71.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.394 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.463 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.1 OUTLIER -76.37 -29.93 57.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.473 179.673 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.652 HD11 ' CG2' ' A' ' 53' ' ' VAL . 9.4 mt -61.6 159.69 12.75 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.976 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -142.27 37.05 1.6 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.489 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.568 ' HA2' HG21 ' A' ' 50' ' ' VAL . . . 67.79 149.93 0.2 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.72 -142.52 13.85 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.476 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -95.29 -36.72 5.33 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.47 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.14 -27.11 65.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.748 0.308 . . . . 0.0 111.043 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.617 HG22 HD22 ' A' ' 44' ' ' LEU . 21.8 t -56.01 -26.3 20.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.371 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -62.93 -32.15 73.39 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.054 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.17 -57.19 13.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.85 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.652 ' CG2' HD11 ' A' ' 44' ' ' LEU . 22.9 t -57.46 -25.94 25.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.209 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -66.17 -32.92 74.65 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.672 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -77.7 -27.85 50.82 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -70.08 -28.72 65.65 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.116 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.041 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.22 -25.6 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.062 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -28.63 59.97 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.587 -179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.24 -37.77 57.23 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -179.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.932 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.4 tt -78.04 -25.24 47.71 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.581 -179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -55.44 10.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.051 0.453 . . . . 0.0 110.268 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -63.56 -26.88 68.9 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.813 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.93 ' HB3' HD21 ' A' ' 30' ' ' LEU . 11.9 mm-40 -60.11 -50.99 71.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.976 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.901 ' CG1' HD22 ' A' ' 30' ' ' LEU . 22.1 mt -61.74 -24.18 33.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.17 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.85 -30.66 71.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.023 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 28.7 mttt -65.9 -61.43 2.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.908 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.564 HD11 HG23 ' A' ' 64' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.989 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.676 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 112.395 -0.282 . . . . 0.0 112.395 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.6 t -116.96 159.98 21.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.84 0.352 . . . . 0.0 110.858 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.85 -55.13 2.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.883 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -69.19 -40.87 80.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.997 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.52 -31.98 64.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.804 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -80.84 -25.89 37.39 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.086 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.52 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER -66.74 -28.31 68.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.224 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -77.56 -31.21 53.09 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.549 -179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.418 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 4.4 pt-20 -77.15 -22.4 52.61 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.714 0.292 . . . . 0.0 111.254 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -54.36 8.76 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.184 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.574 HG22 HG13 ' A' ' 57' ' ' VAL . 25.1 t -65.79 -29.41 46.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.492 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -59.03 -36.78 75.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.68 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.28 -23.97 40.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.488 0.661 . . . . 0.0 109.336 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.07 -25.25 67.73 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.82 179.316 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 54.4 tt0 -78.34 -41.98 31.92 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.212 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -55.14 -30.98 60.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.803 0.335 . . . . 0.0 111.031 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.469 ' HD3' HG21 ' A' ' 64' ' ' ILE . 10.8 tttm -76.08 -42.84 46.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.25 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.663 HG23 ' O ' ' A' ' 14' ' ' LEU . 2.9 t -73.43 -52.55 21.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.475 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.6 mttt -50.01 -31.07 11.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.22 -10.89 36.96 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.36 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.506 HD13 HG12 ' A' ' 27' ' ' ILE . 0.5 OUTLIER -72.33 -69.73 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.936 -179.867 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 160.43 -122.68 1.14 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.489 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.79 128.35 0.98 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.526 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 137.02 90.61 0.27 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.515 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.37 -117.47 4.88 Favored Glycine 0 N--CA 1.452 -0.257 0 C-N-CA 120.713 -0.755 . . . . 0.0 112.509 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.556 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.95 -44.01 86.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.995 -179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.506 HG12 HD13 ' A' ' 21' ' ' LEU . 7.5 mt -64.94 -29.57 47.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.58 -56.35 23.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.708 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.68 -47.02 85.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.933 0.397 . . . . 0.0 111.182 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.889 HD13 HG12 ' A' ' 64' ' ' ILE . 76.4 mt -57.87 -21.06 41.03 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.86 -179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.5 tttt -74.51 -59.1 2.88 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.1 mtmp? -50.9 -46.81 60.73 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.76 -24.66 60.98 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -179.095 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.07 -57.78 9.5 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.585 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.484 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -70.29 -52.45 22.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.767 -178.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.484 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.2 tm-20 -50.18 -28.2 7.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.159 0.504 . . . . 0.0 110.937 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.048 HD21 HG22 ' A' ' 57' ' ' VAL . 8.5 tp -69.86 -43.68 71.38 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.224 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -57.81 -58.29 9.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.314 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.6 ptmt -52.62 -27.9 19.03 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.331 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.77 -25.78 63.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.216 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.2 mt -79.35 -32.81 15.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.784 0.326 . . . . 0.0 111.042 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -66.65 -38.73 87.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.738 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -70.33 -37.54 74.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.54 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.826 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.2 mt -53.55 166.91 0.26 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.049 -179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -128.14 -84.18 0.43 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.503 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -168.31 106.17 0.25 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.544 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.432 ' H ' HG11 ' A' ' 50' ' ' VAL . . . 82.78 147.1 6.64 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.524 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.2 -87.23 0.61 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -95.04 -19.81 19.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.728 0.299 . . . . 0.0 111.058 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.432 HG11 ' H ' ' A' ' 47' ' ' GLY . 14.7 p -49.06 -29.44 3.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.519 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.8 ptmm? -71.98 -29.44 64.24 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.201 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.3 tttt -69.12 -57.34 5.53 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.069 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.826 ' CG2' HD11 ' A' ' 44' ' ' LEU . 21.6 t -56.85 -29.55 30.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.08 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -61.38 -40.41 94.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.49 179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.93 -27.82 65.08 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.682 179.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -68.52 -28.66 67.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.006 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.048 HG22 HD21 ' A' ' 37' ' ' LEU . 18.5 t -82.76 -25.86 8.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.078 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 8.9 mtpt -75.12 -28.18 60.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.513 -179.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -75.65 -38.39 58.86 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 111.879 0.325 . . . . 0.0 111.879 -179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.672 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.22 -25.77 47.13 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.973 0.36 . . . . 0.0 111.973 -179.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.401 ' HG3' ' CD1' ' A' ' 14' ' ' LEU . 0.1 OUTLIER -70.98 -51.35 26.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.017 0.437 . . . . 0.0 110.738 -179.831 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -67.64 -26.65 66.33 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.217 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.723 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -62.74 -59.06 5.41 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.434 -179.422 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.889 HG12 HD13 ' A' ' 30' ' ' LEU . 35.3 mt -50.31 -28.39 5.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.536 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -27.48 65.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.733 0.301 . . . . 0.0 110.895 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.33 -55.26 5.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.672 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.875 HD21 HD11 ' A' ' 30' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.27 -0.872 . . . . 0.0 110.879 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.646 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.146 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.9 p -129.06 135.0 48.33 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.881 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.05 -50.74 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.846 -179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.852 HG22 HG11 ' A' ' 50' ' ' VAL . 15.4 t -82.95 -40.35 16.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.177 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.8 mttm -57.1 -32.0 65.86 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.53 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -77.22 -25.7 51.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.122 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.514 HD11 ' HA ' ' A' ' 54' ' ' GLU . 0.5 OUTLIER -66.09 -39.54 90.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.325 -179.622 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.502 ' HG3' HG21 ' A' ' 41' ' ' ILE . 62.6 mt-10 -67.62 -32.93 73.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.452 -179.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.53 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 3.6 pt-20 -77.27 -20.1 55.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.734 0.302 . . . . 0.0 111.312 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.91 -43.56 58.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.58 HG22 HG13 ' A' ' 57' ' ' VAL . 23.2 t -75.41 -29.3 21.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.475 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -62.75 -35.83 81.06 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.026 0.441 . . . . 0.0 110.182 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.17 -23.86 37.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.549 0.69 . . . . 0.0 109.499 178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.516 HD21 HD23 ' A' ' 60' ' ' LEU . 0.5 OUTLIER -66.38 -25.49 66.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.875 179.439 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 25.1 tt0 -74.93 -51.54 13.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.207 -179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -51.3 -27.33 9.16 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.128 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.9 ttpt -76.05 -40.94 52.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.832 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.662 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 19.1 t -78.08 -52.6 15.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 121.047 0.451 . . . . 0.0 111.068 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.4 mtpp -55.55 -19.92 11.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.33 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.75 -17.57 26.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.43 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.551 ' C ' HD12 ' A' ' 21' ' ' LEU . 1.5 pp -99.95 157.74 16.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.86 0.362 . . . . 0.0 110.808 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.463 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -132.78 161.27 24.04 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.643 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 149.85 -168.32 29.96 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.436 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -145.6 135.43 5.94 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.537 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 123.92 -111.1 1.56 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.55 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.899 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.99 -27.62 61.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.745 0.307 . . . . 0.0 111.063 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.422 HD13 ' CD1' ' A' ' 21' ' ' LEU . 58.8 mt -66.04 -29.73 47.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.464 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -66.21 -56.14 12.77 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.484 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 31.7 tp10 -59.16 -26.87 65.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.78 0.324 . . . . 0.0 111.369 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.646 HD11 ' OE1' ' A' ' 63' ' ' GLU . 92.1 mt -79.56 -21.61 44.88 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.72 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 13.7 tttp -76.74 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.682 0.253 . . . . 0.0 111.682 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.67 -51.55 55.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.79 0.329 . . . . 0.0 111.742 -179.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 1.9 ttpp -66.74 -25.12 66.35 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.844 -179.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.09 -57.62 11.78 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.06 -55.3 14.93 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 112.057 -178.672 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -48.23 -28.44 3.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.061 0.458 . . . . 0.0 111.336 -179.629 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.078 HD21 HG22 ' A' ' 57' ' ' VAL . 7.6 tp -69.07 -41.7 77.19 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.486 -179.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -58.17 8.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.628 -179.353 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HA ' ' HG2' ' A' ' 42' ' ' GLU . 2.9 ptmt -52.1 -27.96 15.97 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.47 -179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 22.1 tttt -70.58 -25.56 63.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.502 HG21 ' HG3' ' A' ' 8' ' ' GLU . 6.9 mt -77.11 -40.79 30.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.788 0.328 . . . . 0.0 111.089 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.424 ' HG2' ' HA ' ' A' ' 39' ' ' LYS . 1.9 pt-20 -65.89 -28.89 69.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.812 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 5.5 pt-20 -77.68 -30.92 52.22 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.053 0.454 . . . . 0.0 110.375 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.64 HD11 ' CG2' ' A' ' 53' ' ' VAL . 6.0 mt -57.94 -176.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.935 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -151.87 -103.35 0.25 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.787 -0.721 . . . . 0.0 112.52 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -151.49 113.87 0.61 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.499 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 173.29 -144.72 7.92 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.561 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -94.96 12.28 68.66 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.797 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.408 ' HG2' HD21 ' A' ' 44' ' ' LEU . 11.8 tt0 -95.08 -24.87 16.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.778 0.323 . . . . 0.0 110.963 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.852 HG11 HG22 ' A' ' 4' ' ' VAL . 31.6 t -56.11 -22.79 14.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.41 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.95 -29.89 55.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.897 -179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt -68.03 -57.27 6.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.95 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.64 ' CG2' HD11 ' A' ' 44' ' ' LEU . 23.8 t -60.19 -29.87 44.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.021 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.514 ' HA ' HD11 ' A' ' 7' ' ' LEU . 7.2 tp10 -62.51 -33.27 74.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.645 179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -27.89 53.38 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.794 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -67.9 -29.21 68.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.912 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.078 HG22 HD21 ' A' ' 37' ' ' LEU . 21.7 t -83.26 -25.61 7.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.032 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.6 mttp -73.44 -28.15 61.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.35 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -43.26 54.74 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.585 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.6 OUTLIER -74.07 -24.98 59.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.054 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -56.0 8.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.937 0.399 . . . . 0.0 110.753 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -61.35 -26.99 68.19 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.153 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.646 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.3 tm-20 -61.99 -58.93 6.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.103 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.551 HG12 HD13 ' A' ' 30' ' ' LEU . 31.5 mt -52.89 -25.2 8.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.269 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.5 71.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.778 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 15.5 mttp -67.91 -44.93 75.78 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.793 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.899 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.075 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.95 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.662 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 91.9 p -137.03 127.59 26.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.908 0.385 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.7 mmt180 -138.14 -64.09 0.54 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.903 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.4 t -80.92 -43.7 20.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.129 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.13 -31.66 61.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.806 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.73 -25.52 53.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.028 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.797 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -67.57 -35.42 78.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.35 -179.663 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.495 ' HG3' HG21 ' A' ' 41' ' ' ILE . 39.2 mt-10 -74.39 -35.8 63.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.694 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.61 -19.7 60.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.704 0.288 . . . . 0.0 111.523 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.0 mttt -73.07 -51.04 19.58 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.202 -179.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.608 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.5 t -68.4 -29.21 43.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.648 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.78 -36.71 77.27 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.564 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.99 -23.92 38.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.532 0.682 . . . . 0.0 109.508 178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.587 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -65.31 -25.14 67.49 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.834 179.271 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.416 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 26.0 tt0 -75.1 -44.95 44.39 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.083 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -52.54 -26.12 12.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.99 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -76.08 -54.45 6.83 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.643 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.4 t -65.0 -53.45 41.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.261 -179.842 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' HG3' ' A' ' 15' ' ' GLU . 3.1 mtpp -53.58 -26.55 22.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.22 -179.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.69 -10.91 38.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.46 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.448 HD22 ' H ' ' A' ' 22' ' ' GLY . 0.6 OUTLIER -78.63 -157.55 0.12 Allowed 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.626 -179.904 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.448 ' H ' HD22 ' A' ' 21' ' ' LEU . . . 164.39 107.86 0.21 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.65 -0.786 . . . . 0.0 112.482 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -156.48 -122.78 0.76 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.484 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 175.06 92.68 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.473 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 146.4 -99.96 0.21 Allowed Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.478 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.88 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -57.04 -27.66 61.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.739 0.304 . . . . 0.0 111.07 -179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 15.5 mt -73.94 -29.61 26.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.293 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -65.05 -56.14 14.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.599 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -61.46 -35.14 76.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.754 0.312 . . . . 0.0 111.202 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.751 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.0 mt -69.97 -21.42 63.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.659 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -76.64 -59.2 2.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.628 0.251 . . . . 0.0 111.577 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.34 -37.08 62.0 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.581 -179.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.446 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -78.48 -24.84 45.72 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.746 -179.452 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -64.95 -57.95 7.4 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.28 -40.5 90.11 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.079 -178.491 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.12 -28.21 69.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.964 0.411 . . . . 0.0 111.081 -179.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.935 HD11 HG22 ' A' ' 57' ' ' VAL . 0.1 OUTLIER -70.18 -55.1 10.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.673 -179.107 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.96 -58.11 6.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.806 0.336 . . . . 0.0 111.596 -179.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.0 -27.92 8.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.413 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.523 ' HE3' HG22 ' A' ' 53' ' ' VAL . 7.0 ttpt -71.09 -28.46 64.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.999 -179.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.495 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.9 mt -75.07 -31.35 24.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.636 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -68.92 -34.45 75.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.274 179.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.0 OUTLIER -72.59 -29.76 63.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.461 179.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.635 HD13 HG23 ' A' ' 50' ' ' VAL . 5.6 mt -57.46 -175.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.945 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -151.4 -81.09 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.546 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -175.5 37.89 0.1 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.478 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -102.48 -160.94 26.06 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.555 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -87.57 8.37 77.62 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.851 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -95.15 -23.2 17.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.832 0.348 . . . . 0.0 110.979 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.635 HG23 HD13 ' A' ' 44' ' ' LEU . 13.6 p -52.55 -30.65 14.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.33 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -60.57 -27.14 67.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.139 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -68.52 -57.25 6.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.063 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.626 ' O ' HG23 ' A' ' 57' ' ' VAL . 23.9 t -53.68 -26.08 12.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.222 179.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.524 ' HG2' HD11 ' A' ' 7' ' ' LEU . 6.7 mt-10 -65.2 -32.6 74.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.482 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -77.56 -27.94 51.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.705 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -68.62 -28.85 67.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.574 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.935 HG22 HD11 ' A' ' 37' ' ' LEU . 2.5 t -83.09 -25.52 8.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.894 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.92 -28.18 61.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.527 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.0 ttmt -75.27 -43.32 51.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.751 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -74.91 -25.15 58.71 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -178.999 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.16 -54.1 12.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 -179.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -62.87 -27.02 69.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.108 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.621 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.7 -59.0 5.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.142 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.479 HG12 HD13 ' A' ' 30' ' ' LEU . 29.9 mt -55.16 -26.15 17.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.104 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 mptt -61.72 -34.23 75.42 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.879 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 7.8 mtpt -64.26 -56.04 17.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.8 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.88 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.889 179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.643 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.3 m -146.25 177.22 9.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.904 0.383 . . . . 0.0 110.9 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.03 -66.89 0.77 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.85 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.6 t -72.82 -42.65 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.071 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.9 mttp -55.87 -31.84 63.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.757 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -79.75 -25.56 41.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.993 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.58 -28.96 68.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.272 -179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.467 ' HG2' HG21 ' A' ' 41' ' ' ILE . 29.7 mt-10 -79.01 -39.71 33.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.408 -179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.53 -19.75 62.87 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.4 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -53.9 15.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.42 -179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.605 HG22 HG13 ' A' ' 57' ' ' VAL . 19.6 t -66.54 -29.3 46.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.754 -179.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -59.48 -36.71 76.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.628 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.42 -23.83 40.05 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.576 0.703 . . . . 0.0 109.393 178.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.646 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.41 -25.26 67.46 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.912 179.314 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.401 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 42.0 tt0 -77.33 -52.89 8.42 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.241 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -49.99 -27.95 6.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.894 0.378 . . . . 0.0 111.197 -179.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.8 ttpp -76.09 -42.74 46.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.661 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 14.8 t -76.41 -48.44 27.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.441 -179.767 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.2 OUTLIER -50.02 -32.38 15.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.273 -179.58 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.1 -10.82 40.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.45 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.72 HD23 ' H ' ' A' ' 22' ' ' GLY . 0.3 OUTLIER -63.57 165.25 8.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.895 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.72 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -70.7 -123.03 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.42 179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -171.5 124.59 1.12 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.469 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.423 ' N ' HD12 ' A' ' 27' ' ' ILE . . . -157.57 -110.68 0.3 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.567 -179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -120.88 -56.91 0.23 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.734 -0.745 . . . . 0.0 112.621 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.78 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.43 -27.72 62.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.76 0.314 . . . . 0.0 111.01 -179.951 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.423 HD12 ' N ' ' A' ' 24' ' ' GLY . 59.2 mt -67.65 -29.72 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.368 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.45 -56.18 12.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.659 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -59.63 -27.56 66.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.297 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.585 ' O ' HD11 ' A' ' 60' ' ' LEU . 84.5 mt -78.87 -21.58 47.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.749 -179.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.0 -58.66 3.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.715 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.35 -43.28 61.77 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.758 0.313 . . . . 0.0 111.824 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.86 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.015 -179.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.25 -57.78 9.32 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.733 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -46.54 68.72 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -54.22 -28.07 38.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.075 0.464 . . . . 0.0 110.855 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.98 HD21 HG22 ' A' ' 57' ' ' VAL . 7.8 tp -70.88 -42.74 69.62 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.529 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.3 9.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.797 -179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.6 ptmt -51.34 -27.76 10.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.661 -179.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.08 -25.97 60.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.296 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.467 HG21 ' HG2' ' A' ' 8' ' ' GLU . 10.0 mt -71.26 -57.03 8.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.8 0.333 . . . . 0.0 110.681 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.18 -23.93 64.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.128 0.49 . . . . 0.0 110.038 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -86.33 -12.98 47.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.206 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.527 HD11 ' CG2' ' A' ' 53' ' ' VAL . 2.2 mt -71.32 164.22 26.15 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.914 0.388 . . . . 0.0 110.902 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -103.97 -103.39 2.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.514 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -159.74 126.95 1.72 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.604 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 62.71 144.34 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.622 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.99 -88.91 1.43 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.654 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.442 ' HG2' HD21 ' A' ' 44' ' ' LEU . 22.2 tt0 -57.26 -27.7 62.31 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.761 0.315 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.462 ' HA ' HD13 ' A' ' 44' ' ' LEU . 27.1 t -55.34 -24.65 15.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.37 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.79 -28.77 58.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.932 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.41 -57.41 6.62 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.87 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.57 ' O ' HG23 ' A' ' 57' ' ' VAL . 24.7 t -62.59 -26.02 39.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.147 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -67.09 -34.66 78.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.615 179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -75.56 -27.96 58.82 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.798 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -70.57 -28.94 65.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.009 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.98 HG22 HD21 ' A' ' 37' ' ' LEU . 21.3 t -83.13 -25.84 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.168 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.22 -28.48 59.96 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.655 -179.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.31 -42.01 46.67 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.646 HD23 HD21 ' A' ' 14' ' ' LEU . 0.4 OUTLIER -75.48 -25.0 57.0 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.754 0.279 . . . . 0.0 111.754 -179.261 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.06 -55.35 9.72 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.984 0.421 . . . . 0.0 110.552 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.64 -27.0 68.92 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.242 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.21 -59.11 5.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.283 -179.639 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.623 HD13 HG22 ' A' ' 18' ' ' VAL . 30.3 mt -54.42 -26.41 15.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.211 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.07 -33.35 75.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.889 179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.1 mmtt -68.06 -58.99 3.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.756 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.78 HD22 ' CG ' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.956 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.661 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.142 0 N-CA-C 112.496 -0.242 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.35 -176.76 0.1 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.839 0.352 . . . . 0.0 110.913 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.3 ttt85 -133.95 -63.04 0.75 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.887 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.5 t -74.15 -35.44 40.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.079 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.68 -28.07 66.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.02 -25.26 40.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.111 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 -32.22 67.94 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.358 -179.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -83.09 -35.55 25.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.355 -179.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -73.13 -19.72 61.08 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.036 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -55.05 8.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.991 -179.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.507 HG22 HG13 ' A' ' 57' ' ' VAL . 21.3 t -63.89 -29.37 47.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.277 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.72 -36.97 75.15 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.624 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.8 -23.98 41.72 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.461 0.648 . . . . 0.0 109.635 178.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.71 HD21 HD23 ' A' ' 60' ' ' LEU . 2.5 tt -65.39 -25.45 67.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.721 179.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.426 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 36.3 tt0 -77.0 -40.57 46.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.246 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -54.29 -27.94 38.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.051 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.461 ' HE2' HG21 ' A' ' 64' ' ' ILE . 2.9 ttpm? -76.21 -47.67 23.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.218 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.677 ' O ' HD12 ' A' ' 21' ' ' LEU . 2.6 t -70.55 -53.31 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.445 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 5.0 mttt -50.05 -30.82 11.58 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.478 -179.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.21 -10.99 60.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.541 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.821 HD13 ' O ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -62.82 167.56 4.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.456 -179.714 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.559 ' N ' HD22 ' A' ' 21' ' ' LEU . . . -154.58 22.5 0.63 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.605 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.63 -121.87 2.35 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.518 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -176.01 173.33 46.19 Favored Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.491 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 104.91 -114.24 4.59 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.475 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.651 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -52.8 -43.53 65.96 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.048 179.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.786 HG21 ' HG ' ' A' ' 21' ' ' LEU . 3.6 mt -59.7 -29.41 42.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.754 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.47 -56.27 24.12 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -179.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -58.25 -38.59 77.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.05 0.453 . . . . 0.0 111.187 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.788 HD13 HG12 ' A' ' 64' ' ' ILE . 16.2 mt -66.15 -21.09 66.32 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.657 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -75.45 -55.93 5.21 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -53.83 -51.45 63.53 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.735 0.302 . . . . 0.0 111.606 -179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -68.15 -25.05 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.931 -179.251 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.86 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -68.04 -54.27 19.61 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.621 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.499 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.2 tt0 -48.53 -28.37 3.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.062 0.458 . . . . 0.0 111.19 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.013 HD21 HG22 ' A' ' 57' ' ' VAL . 3.2 tp -68.87 -41.14 78.77 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.259 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 26.4 mttm -61.7 -58.27 8.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.15 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.27 -27.98 25.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.251 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.423 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 27.3 tttt -68.9 -27.43 65.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.967 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.444 HG12 HG11 ' A' ' 53' ' ' VAL . 8.9 mt -73.88 -31.06 29.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.903 0.382 . . . . 0.0 110.653 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -69.56 -34.6 74.42 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.423 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -72.53 -29.1 63.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.6 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.469 HD11 ' CG2' ' A' ' 53' ' ' VAL . 5.4 mt -58.34 169.33 0.89 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.994 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -132.99 -117.39 1.82 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.519 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -73.27 -138.79 0.36 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.511 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -91.74 177.25 40.22 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.663 -0.78 . . . . 0.0 112.613 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 95.8 -79.36 0.8 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.496 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' HG2' HD21 ' A' ' 44' ' ' LEU . 27.1 tt0 -63.08 -18.0 62.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.695 0.283 . . . . 0.0 111.191 -179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.22 -16.92 17.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.565 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.19 -33.21 65.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.796 0.332 . . . . 0.0 111.098 -179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 tptp -65.99 -57.28 8.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.929 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.539 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.5 t -59.89 -25.73 33.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.216 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.32 -37.28 85.02 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.554 179.804 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -72.72 -27.74 62.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -70.67 -29.7 66.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.031 -179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.013 HG22 HD21 ' A' ' 37' ' ' LEU . 19.8 t -83.33 -25.87 7.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.204 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.1 mttm -75.34 -28.42 59.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.667 -179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.33 -41.28 57.1 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -178.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.71 HD23 HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -78.16 -26.16 47.61 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -178.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.487 ' HG3' HD12 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -70.53 -49.38 48.77 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.088 0.47 . . . . 0.0 110.728 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -69.11 -26.82 65.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.4 179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.623 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -63.41 -59.1 5.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.29 -179.429 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.788 HG12 HD13 ' A' ' 30' ' ' LEU . 39.6 mt -50.58 -28.41 5.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.387 -179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -64.43 -31.49 72.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.908 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -71.61 -55.83 7.01 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.628 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.651 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.231 -0.89 . . . . 0.0 110.866 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.62 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.141 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 51.1 p -152.05 31.18 0.55 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.744 0.307 . . . . 0.0 110.871 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -139.34 -75.4 0.36 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.896 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.1 t -66.67 -30.76 50.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.036 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -57.88 -30.73 66.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.65 179.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 9' ' ' GLU . . . -77.67 -25.36 49.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.085 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.12 -31.49 69.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.301 -179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -82.24 -37.99 25.15 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.58 -179.473 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 6' ' ' ALA . 0.7 OUTLIER -71.05 -19.87 62.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.782 0.325 . . . . 0.0 111.147 -179.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.81 -52.84 10.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.896 -179.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.422 HG22 HG13 ' A' ' 57' ' ' VAL . 18.1 t -61.71 -29.19 45.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.426 -179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -37.26 73.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.774 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.1 -24.34 40.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.477 0.656 . . . . 0.0 109.611 178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.685 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.2 tt -65.36 -25.18 67.47 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.761 179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 56.8 tt0 -79.09 -42.72 25.66 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.353 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -53.7 -27.54 28.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.105 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 tppt? -76.16 -48.36 20.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.249 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.657 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.2 t -70.78 -49.6 49.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.618 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 10.2 mttt -51.24 -31.73 21.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.798 0.333 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.32 -10.85 55.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.419 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.785 HD11 HD13 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -77.67 165.29 24.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.664 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.503 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -67.86 -81.01 0.19 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.315 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 129.78 128.85 3.06 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.561 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 136.5 88.39 0.23 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.525 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 115.61 -117.34 3.93 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.583 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.519 ' HG2' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.34 -27.54 64.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.798 0.333 . . . . 0.0 111.023 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.613 HG12 HD13 ' A' ' 21' ' ' LEU . 22.3 mt -73.55 -29.61 27.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.467 -179.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -63.55 -56.18 18.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.684 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.91 -42.82 94.74 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.392 -179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.58 HD13 HG12 ' A' ' 64' ' ' ILE . 53.7 mt -63.63 -21.41 66.35 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.811 -179.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -75.81 -59.08 2.91 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 -179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.2 tttp -50.59 -56.32 12.31 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.768 0.318 . . . . 0.0 111.753 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -61.74 -24.99 67.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.767 -179.422 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -61.04 -57.88 10.73 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -178.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.518 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.14 -56.44 9.95 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.277 -0.419 . . . . 0.0 112.072 -178.498 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.518 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 0.6 OUTLIER -47.94 -28.36 2.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.916 0.388 . . . . 0.0 111.412 -179.639 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.059 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -67.54 -39.88 85.03 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.344 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -58.2 5.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.469 -179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 0.3 OUTLIER -52.89 -27.68 19.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.341 -179.743 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.409 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 10.6 tttt -68.5 -28.73 67.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.903 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.1 mt -73.63 -31.0 30.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.657 179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -69.19 -33.93 74.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.466 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.7 OUTLIER -73.24 -29.2 62.61 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.62 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.487 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.7 mt -59.11 163.44 3.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.901 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.83 -44.71 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.483 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 139.77 127.46 2.41 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.603 179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 166.13 -34.22 0.23 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 160.58 -28.47 0.32 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.472 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.487 ' HB3' HD21 ' A' ' 44' ' ' LEU . 0.8 OUTLIER -58.96 -21.31 58.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.706 0.289 . . . . 0.0 111.118 179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.3 t -53.37 -24.69 9.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.439 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.9 mttt -72.43 -36.5 68.59 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.89 0.376 . . . . 0.0 110.973 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -62.96 -57.23 11.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.9 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.487 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.3 t -57.93 -28.05 32.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.372 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -64.46 -36.24 83.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 110.728 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -74.34 -27.73 60.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.969 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -70.27 -29.26 65.99 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.377 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.059 HG22 HD21 ' A' ' 37' ' ' LEU . 17.5 t -83.27 -26.67 7.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.347 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.47 -28.38 59.23 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.691 -179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tmmt? -76.79 -40.77 47.02 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.51 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.08 -25.81 47.84 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.978 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.81 -52.41 17.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.878 0.371 . . . . 0.0 110.55 -179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -65.46 -26.97 68.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.085 179.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -62.48 -59.13 5.4 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.163 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.835 HG23 HD11 ' A' ' 67' ' ' LEU . 35.2 mt -55.01 -25.69 16.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.254 -179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.02 -31.85 61.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.369 -179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.7 mtmm -105.08 -69.35 0.82 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.236 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.835 HD11 HG23 ' A' ' 64' ' ' ILE . 87.5 mt . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.657 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.157 0 N-CA-C 112.576 -0.209 . . . . 0.0 112.576 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.3 m -110.73 133.13 53.6 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.902 0.382 . . . . 0.0 110.909 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.96 -48.54 2.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.912 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 p -82.95 -33.44 10.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.125 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.3 ttpp -58.29 -33.86 69.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.836 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.49 -25.88 35.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.07 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.421 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -65.6 -28.03 68.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.065 -179.964 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.404 ' CG ' ' CG2' ' A' ' 41' ' ' ILE . 53.7 mt-10 -75.5 -37.0 60.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.279 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.45 -19.95 60.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.432 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.22 -48.81 40.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.843 0.354 . . . . 0.0 111.006 -179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.444 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.6 t -68.64 -29.3 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.514 -179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.0 -36.52 77.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.458 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.09 -23.86 40.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.639 0.733 . . . . 0.0 109.407 178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.749 ' O ' HG23 ' A' ' 18' ' ' VAL . 0.4 OUTLIER -65.71 -25.22 67.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 114.806 -1.088 . . . . 0.0 110.982 179.38 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -75.87 -55.33 5.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.398 -179.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -47.14 -30.91 3.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.1 -37.94 57.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.769 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.749 HG23 ' O ' ' A' ' 14' ' ' LEU . 21.4 t -78.15 -48.66 22.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.303 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -50.9 -31.55 17.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.335 -179.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.16 -10.98 39.81 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.542 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.689 HD11 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -66.45 -69.0 0.33 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.841 0.353 . . . . 0.0 110.909 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 153.03 -117.86 0.84 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.528 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 164.13 126.58 0.83 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.508 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 149.65 84.83 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.55 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 114.0 -118.15 4.35 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.537 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.768 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -64.03 -27.81 69.37 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.731 0.301 . . . . 0.0 111.023 -179.932 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.455 ' CD1' HD22 ' A' ' 21' ' ' LEU . 25.6 mt -65.42 -29.76 48.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.501 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -64.66 -56.25 15.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.661 -179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -60.06 -26.89 66.5 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.727 0.298 . . . . 0.0 111.226 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.572 ' O ' HD11 ' A' ' 60' ' ' LEU . 87.9 mt -77.21 -21.77 53.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.517 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.32 -59.44 2.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.688 0.28 . . . . 0.0 111.724 -179.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.03 -37.82 61.86 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.786 0.327 . . . . 0.0 111.722 -179.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -79.77 -24.87 41.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.831 -179.409 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.7 -57.96 8.37 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.794 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.78 -44.04 74.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.552 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.31 -27.98 50.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.189 0.519 . . . . 0.0 110.561 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.115 HD21 HG22 ' A' ' 57' ' ' VAL . 12.5 tp -76.55 -38.9 54.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.536 -179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -28.48 69.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.295 -0.411 . . . . 0.0 112.107 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -79.05 -27.63 43.13 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.4 tttm -73.13 -34.18 65.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.49 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.41 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 12.3 mt -67.37 -57.7 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.721 0.296 . . . . 0.0 110.701 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -58.28 -23.97 57.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.195 0.521 . . . . 0.0 110.044 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -84.81 -12.88 52.67 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.162 179.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 44' ' ' LEU . 4.2 mt -77.58 162.49 27.04 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.939 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -117.04 -63.06 0.32 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.406 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.512 ' HA2' HG21 ' A' ' 50' ' ' VAL . . . 148.69 137.6 2.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.519 179.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 149.69 -99.31 0.19 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.525 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -122.26 -38.38 0.6 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.457 -179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.8 -25.07 60.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.748 0.309 . . . . 0.0 111.115 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.512 HG21 ' HA2' ' A' ' 46' ' ' GLY . 21.9 t -56.69 -22.19 14.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.417 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -72.99 -29.73 63.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.04 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.1 -57.29 6.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.867 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.401 ' O ' HG23 ' A' ' 57' ' ' VAL . 17.1 t -57.91 -28.1 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 -37.78 88.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.479 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -71.81 -27.99 63.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.728 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -68.57 -30.28 69.02 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.872 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.115 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.03 -25.55 8.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.164 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.7 -27.92 61.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.458 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.407 ' CE ' ' HG3' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -75.24 -40.94 58.52 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -178.95 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.581 HD23 HD21 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -76.89 -25.09 52.63 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -179.032 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.63 -53.74 14.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.639 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -64.75 -26.89 68.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.019 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.524 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.26 -59.09 5.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.138 -179.774 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.699 HD13 HG22 ' A' ' 18' ' ' VAL . 28.1 mt -56.42 -25.41 20.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.231 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.36 75.67 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.922 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 39.9 mtpt -71.25 -57.75 4.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.738 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.768 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.896 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.641 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 p -64.66 155.45 33.37 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.82 0.343 . . . . 0.0 110.915 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.78 -67.08 0.16 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.899 -179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -82.94 -37.76 14.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.205 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -32.85 67.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.674 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -76.66 -25.5 53.81 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.032 179.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.497 ' CD2' HG21 ' A' ' 57' ' ' VAL . 0.5 OUTLIER -69.61 -30.47 68.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.334 -179.701 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.416 ' HG2' HG21 ' A' ' 41' ' ' ILE . 30.7 mt-10 -80.27 -37.69 32.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.504 -179.439 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.52 -19.74 61.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.348 -179.799 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.18 -48.96 25.67 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.447 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.635 HG22 HG13 ' A' ' 57' ' ' VAL . 17.8 t -68.21 -29.2 43.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.709 -179.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -36.49 77.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.606 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.05 -24.0 38.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.445 0.64 . . . . 0.0 109.768 178.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.704 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.5 tt -66.37 -25.08 66.62 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.753 179.497 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.417 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 27.6 tt0 -77.27 -46.46 23.01 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -179.626 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -49.6 -27.86 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 9.3 tttp -76.21 -48.69 19.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.388 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.622 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.7 t -70.0 -51.46 39.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.469 -179.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 9.7 mttt -51.0 -31.17 17.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.798 0.333 . . . . 0.0 111.129 -179.605 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.62 -10.91 47.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.472 179.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.842 HD22 HD13 ' A' ' 27' ' ' ILE . 0.3 OUTLIER -71.73 165.48 23.95 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.734 -179.986 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.666 ' H ' HD23 ' A' ' 21' ' ' LEU . . . -154.35 93.88 0.14 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.516 -179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.405 ' CA ' HD12 ' A' ' 27' ' ' ILE . . . -172.97 -139.01 2.73 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.588 179.852 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -164.36 -173.61 33.21 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.472 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.64 -110.62 3.13 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.509 -179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.871 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.8 -27.74 63.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.725 0.298 . . . . 0.0 110.955 179.899 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.842 HD13 HD22 ' A' ' 21' ' ' LEU . 29.4 mt -67.63 -29.79 46.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.711 -179.352 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.92 -43.65 71.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.93 -179.179 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -70.14 -26.85 64.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.685 0.279 . . . . 0.0 111.432 -179.419 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 72.8 mt -81.06 -21.62 39.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.494 -179.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 9.9 tttp -76.74 -59.15 2.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.343 -179.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -52.64 -48.23 66.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.64 -179.539 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -68.22 -25.2 65.09 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.736 -179.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.445 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -62.25 -57.87 9.83 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -179.001 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.503 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -65.87 -55.06 18.96 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.904 -178.596 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.503 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 7.7 tt0 -49.33 -28.47 4.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.948 0.404 . . . . 0.0 111.306 -179.628 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.027 HD21 HG22 ' A' ' 57' ' ' VAL . 5.0 tp -67.96 -38.56 82.91 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.281 -179.658 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -66.48 -58.36 5.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.259 -179.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.439 ' CD ' ' HA ' ' A' ' 36' ' ' GLU . 3.1 pttt -51.61 -27.51 11.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.202 -179.871 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.484 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 2.7 tptm -70.8 -25.81 63.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.137 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.416 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.0 mt -75.71 -42.1 40.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.733 0.301 . . . . 0.0 111.08 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -63.26 -30.72 71.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.608 179.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 2.9 pt-20 -75.62 -30.66 59.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.095 0.474 . . . . 0.0 110.513 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.606 HD21 ' HB3' ' A' ' 49' ' ' GLU . 5.3 mt -56.86 162.4 2.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.791 179.939 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.96 -96.58 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.662 -179.879 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -161.94 57.27 0.3 Allowed Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.51 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -113.81 -27.46 3.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.542 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.79 -16.39 4.0 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.692 -179.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.606 ' HB3' HD21 ' A' ' 44' ' ' LEU . 11.7 tt0 -62.14 -17.28 57.39 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.604 0.24 . . . . 0.0 111.334 -179.883 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.3 t -52.5 -25.11 7.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 120.733 0.302 . . . . 0.0 111.531 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -70.55 -28.6 65.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.958 179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tttp -73.29 -57.18 4.2 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.974 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.552 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.4 t -55.51 -26.3 19.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.479 -179.74 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -65.41 -38.05 88.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.99 0.424 . . . . 0.0 110.591 179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.9 tt0 -72.32 -27.61 62.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.893 179.804 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -71.41 -28.9 64.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.493 -179.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.027 HG22 HD21 ' A' ' 37' ' ' LEU . 16.9 t -83.32 -27.7 7.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.283 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.2 mtmm -75.61 -28.42 58.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.653 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.4 ttmt -76.29 -40.18 52.33 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.057 0.392 . . . . 0.0 112.057 -178.81 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.07 -26.16 48.05 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.087 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -71.05 -49.47 44.4 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.934 0.397 . . . . 0.0 110.637 -179.839 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -68.72 -26.9 65.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.238 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.506 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.9 OUTLIER -62.36 -59.26 5.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.095 -179.631 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.58 HG12 HD13 ' A' ' 30' ' ' LEU . 39.1 mt -51.31 -25.86 4.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.252 179.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.74 -33.99 75.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.856 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -43.82 79.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.818 179.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.871 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.255 -0.878 . . . . 0.0 111.015 179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.622 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.94 -175.77 2.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.809 0.337 . . . . 0.0 110.827 -179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 19.8 ttm-85 -84.14 -31.78 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.856 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.674 HG22 ' CG2' ' A' ' 50' ' ' VAL . 18.1 t -66.77 -28.09 42.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.194 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.23 -37.3 66.99 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.832 179.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.429 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -73.67 -25.85 60.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.059 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.401 HD21 HG21 ' A' ' 57' ' ' VAL . 0.7 OUTLIER -66.15 -29.31 69.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.195 -179.804 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.511 ' HG3' HG21 ' A' ' 41' ' ' ILE . 45.9 mt-10 -76.76 -31.38 57.03 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.601 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 5.8 pt-20 -77.05 -22.34 53.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.731 0.3 . . . . 0.0 111.307 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.28 -55.04 8.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.01 -179.835 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.587 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -65.4 -29.38 47.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.508 -179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.45 -37.18 74.89 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.718 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.05 -24.26 40.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.613 0.72 . . . . 0.0 109.468 178.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.654 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -64.52 -25.2 67.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.815 179.237 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.418 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 47.6 tt0 -77.56 -43.89 30.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.277 -179.417 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -52.94 -29.69 30.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.188 -179.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.6 tttp -76.03 -50.57 14.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.346 -179.786 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.692 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 28.3 t -66.19 -53.1 40.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.509 -179.632 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.418 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 1.5 mttt -50.52 -30.51 13.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.353 -179.497 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.06 -11.06 36.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.435 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.778 HD13 HG12 ' A' ' 27' ' ' ILE . 0.6 OUTLIER -68.99 -70.0 0.3 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.106 -179.86 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.56 163.06 38.6 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.508 -179.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 103.29 -163.43 15.75 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.525 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -141.71 -179.75 19.07 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.508 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.59 -101.96 2.18 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.47 179.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.426 ' HD2' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -57.28 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.932 0.396 . . . . 0.0 110.906 179.919 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.778 HG12 HD13 ' A' ' 21' ' ' LEU . 2.8 mp -55.88 -29.46 26.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.769 -179.589 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.23 -56.27 24.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -179.201 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -59.02 -32.57 69.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.994 0.426 . . . . 0.0 111.091 -179.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.956 HD23 ' HG ' ' A' ' 60' ' ' LEU . 4.5 mt -70.7 -21.13 62.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.555 -179.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -78.1 -57.61 3.7 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.048 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -58.42 6.7 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.85 0.357 . . . . 0.0 111.789 -179.138 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.413 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -62.2 -25.02 67.56 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -179.338 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.513 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -60.15 -57.53 12.43 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -178.912 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.77 -54.12 26.01 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 111.922 0.342 . . . . 0.0 111.922 -178.596 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.495 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.5 tm-20 -47.94 -28.38 2.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.033 0.444 . . . . 0.0 111.204 -179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.012 HD21 HG22 ' A' ' 57' ' ' VAL . 9.2 tp -70.96 -40.58 71.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.3 -179.563 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -61.88 -58.33 8.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.604 -179.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.7 ptmt -51.42 -28.04 11.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.386 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.426 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -70.0 -28.66 65.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.88 -179.955 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.511 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.8 mt -75.18 -31.61 24.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.673 179.654 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -69.77 -31.45 69.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.392 179.642 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.442 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -75.61 -29.47 59.24 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.483 179.624 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.442 ' N ' ' HG3' ' A' ' 43' ' ' GLU . 4.6 mt -56.82 -178.38 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.954 179.975 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.98 -72.14 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.48 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -131.36 -138.21 4.19 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.494 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -78.06 174.56 54.89 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.528 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 101.31 -68.4 0.43 Allowed Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.553 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -95.04 -21.2 18.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.821 0.343 . . . . 0.0 111.069 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.674 ' CG2' HG22 ' A' ' 4' ' ' VAL . 14.9 p -50.7 -29.55 7.2 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.53 -179.973 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.0 ttmm -72.06 -29.91 64.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.158 -179.863 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.1 ttmt -67.4 -57.25 6.91 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.919 -179.821 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.509 ' O ' HG23 ' A' ' 57' ' ' VAL . 43.6 t -59.61 -25.92 33.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.044 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -65.53 -37.08 85.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.95 0.405 . . . . 0.0 110.472 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -73.04 -27.87 62.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.719 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.98 -29.01 66.0 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.031 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.012 HG22 HD21 ' A' ' 37' ' ' LEU . 22.3 t -83.23 -25.69 7.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.177 179.937 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -75.2 -28.34 59.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.506 -179.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.23 -39.44 59.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.664 -0.244 . . . . 0.0 111.646 -179.088 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.956 ' HG ' HD23 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -77.25 -24.88 51.1 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.54 0.21 . . . . 0.0 111.52 -179.566 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.56 -55.01 13.07 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.008 0.432 . . . . 0.0 110.283 179.772 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -63.94 -26.92 68.81 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.976 179.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 1.8 mt-10 -60.45 -51.33 69.92 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.026 -179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.861 ' CG1' HD22 ' A' ' 30' ' ' LEU . 24.4 mt -59.39 -25.68 31.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.915 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.37 -34.68 75.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.833 179.885 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.4 -64.35 0.98 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.756 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.75 HD13 HD11 ' A' ' 21' ' ' LEU . 2.4 pp . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.132 179.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.692 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -119.11 147.68 43.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.875 0.369 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 6.4 tmm_? -107.45 -61.72 1.52 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.855 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.2 t -59.67 -37.23 69.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.179 -179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -27.57 63.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.81 179.829 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.096 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.551 HD11 ' HG2' ' A' ' 54' ' ' GLU . 0.4 OUTLIER -70.7 -30.93 67.63 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.173 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.565 ' HG2' HG21 ' A' ' 41' ' ' ILE . 33.2 mt-10 -83.16 -39.71 20.68 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.248 -179.605 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.9 -19.71 64.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.147 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.67 -55.13 9.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.149 -179.71 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.63 HG22 ' CG1' ' A' ' 57' ' ' VAL . 22.0 t -62.56 -29.34 46.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.52 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.78 -36.98 75.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.654 179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.75 -23.87 41.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.566 0.698 . . . . 0.0 109.721 178.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.699 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -66.61 -25.09 66.45 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.919 179.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 30.3 tt0 -79.12 -52.71 7.82 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.438 -179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -47.36 -30.23 3.08 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.837 0.351 . . . . 0.0 111.329 -179.647 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.571 ' HD3' HG21 ' A' ' 64' ' ' ILE . 15.5 tttm -76.19 -36.86 58.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.011 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.648 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 24.9 t -78.21 -54.22 12.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.35 -179.802 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.3 OUTLIER -50.53 -29.83 11.53 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.44 -179.493 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.35 -12.83 36.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.444 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.786 HD11 HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -63.79 -60.74 2.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.945 -179.907 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.09 -95.09 0.24 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.528 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.547 ' C ' HD12 ' A' ' 27' ' ' ILE . . . 174.25 176.52 42.71 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.516 -179.93 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 152.03 -114.29 0.63 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.487 179.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -115.34 -72.48 0.52 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.505 179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.793 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.68 -27.7 59.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.888 0.375 . . . . 0.0 111.099 -179.973 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.547 HD12 ' C ' ' A' ' 23' ' ' GLY . 36.2 mt -68.29 -29.6 44.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -64.05 -56.12 17.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.702 -179.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -57.86 -35.95 71.67 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.874 0.369 . . . . 0.0 111.223 -179.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.603 HD22 ' HG ' ' A' ' 60' ' ' LEU . 64.9 mt -70.72 -21.32 62.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.691 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -75.28 -59.14 2.88 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -179.161 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.39 -51.97 41.52 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -179.196 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.459 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 5.1 ttpt -67.55 -24.93 65.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.29 -0.413 . . . . 0.0 112.084 -179.198 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.444 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.91 -57.74 11.37 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.951 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -67.66 -54.09 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.055 -178.704 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.487 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 5.9 tt0 -48.25 -28.57 3.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.075 0.464 . . . . 0.0 111.103 -179.826 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.992 HD21 HG22 ' A' ' 57' ' ' VAL . 8.4 tp -69.47 -40.29 77.2 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.696 -0.684 . . . . 0.0 111.186 -179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -58.13 9.1 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.358 -179.769 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 5.4 ptmt -54.65 -29.44 52.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.293 -179.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.1 ttpp -64.45 -26.82 68.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.0 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.58 ' HA ' HD12 ' A' ' 44' ' ' LEU . 8.2 mt -75.39 -30.2 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.803 0.335 . . . . 0.0 110.819 179.776 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.11 -45.8 83.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.616 179.706 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -62.14 -38.87 90.6 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.378 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.936 HD11 HG21 ' A' ' 53' ' ' VAL . 11.0 mt -51.19 173.4 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.072 179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -137.94 -76.82 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.553 -179.912 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 173.73 54.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.507 179.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -125.83 -117.2 2.15 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.755 -0.735 . . . . 0.0 112.48 179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -106.66 -25.23 6.34 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.622 179.957 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -56.83 -27.67 60.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.702 0.287 . . . . 0.0 111.035 -179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 16.1 t -54.91 -23.89 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.341 -179.968 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -72.36 -34.96 68.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.012 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttt -66.6 -57.32 7.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.93 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.936 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -57.55 -25.95 25.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.342 179.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.551 ' HG2' HD11 ' A' ' 7' ' ' LEU . 1.8 mt-10 -66.0 -37.74 86.71 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.921 0.391 . . . . 0.0 110.62 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.37 -27.89 62.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.859 179.752 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -71.07 -28.89 64.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.992 HG22 HD21 ' A' ' 37' ' ' LEU . 21.5 t -83.32 -25.98 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.037 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.9 mttt -75.46 -28.61 59.34 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.795 -179.49 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.09 -39.96 63.05 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.904 0.335 . . . . 0.0 111.904 -178.91 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.603 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.38 -26.21 46.51 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.228 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -71.47 -40.35 70.33 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.969 0.414 . . . . 0.0 110.892 -179.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -76.48 -26.83 55.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.227 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.578 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.51 -59.28 4.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.153 -179.739 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.644 HD13 HG22 ' A' ' 18' ' ' VAL . 38.7 mt -51.97 -27.95 9.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.286 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -62.17 -33.15 73.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.897 179.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.33 -52.41 27.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.858 179.984 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.793 HD22 ' HG3' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.937 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.648 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.224 0 N-CA-C 112.544 -0.222 . . . . 0.0 112.544 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 60.17 88.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.827 0.346 . . . . 0.0 110.873 -179.972 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -75.47 0.58 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.932 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.754 HG22 HG11 ' A' ' 50' ' ' VAL . 21.3 t -83.0 -46.7 18.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.243 179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 tmmm? -54.67 -31.37 57.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.819 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -83.18 -25.87 31.4 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.111 179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.852 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER -63.81 -30.96 71.99 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.149 -179.896 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -71.32 -33.89 70.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.206 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 2.0 pt-20 -77.21 -19.53 56.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.509 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.58 -39.07 32.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.814 -179.232 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.424 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.1 t -79.16 -29.55 13.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.107 0.41 . . . . 0.0 112.107 -179.121 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -65.51 -34.68 78.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.054 0.454 . . . . 0.0 110.087 179.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.63 -25.07 35.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.606 178.463 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.649 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.7 tt -66.55 -25.6 66.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.863 179.596 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -76.77 -46.33 25.59 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.018 -179.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -51.75 -27.05 10.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.064 179.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.02 -43.85 42.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.069 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.62 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.3 t -76.78 -57.45 5.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.258 -179.807 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.5 mtmt -53.06 -23.83 8.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.236 -179.799 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.74 -18.14 26.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.125 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.784 HD12 ' N ' ' A' ' 22' ' ' GLY . 1.2 pp -103.15 171.31 7.45 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.941 179.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.784 ' N ' HD12 ' A' ' 21' ' ' LEU . . . -178.54 146.04 7.16 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.519 179.871 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.71 87.31 1.87 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.574 179.985 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 150.96 134.89 2.26 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.577 179.921 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.16 -38.95 95.21 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.582 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.766 ' CG ' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.03 -27.65 54.1 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.777 0.322 . . . . 0.0 111.13 -179.947 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.432 HD13 ' CD1' ' A' ' 21' ' ' LEU . 53.7 mt -65.08 -29.64 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.479 -179.63 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -64.15 -56.1 17.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.697 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -60.13 -28.02 67.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.693 0.282 . . . . 0.0 111.328 -179.666 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.709 ' O ' HD11 ' A' ' 60' ' ' LEU . 88.5 mt -76.5 -21.62 55.55 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.639 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.9 tttm -78.22 -59.52 2.74 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.249 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.42 -36.96 46.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.826 0.346 . . . . 0.0 111.829 -179.258 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.704 ' HE2' HD12 ' A' ' 60' ' ' LEU . 2.6 ttpt -82.19 -24.81 34.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.247 -0.433 . . . . 0.0 112.141 -179.152 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.446 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -65.12 -57.88 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.479 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -42.46 79.77 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -178.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.85 -28.2 67.31 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.096 0.474 . . . . 0.0 110.918 -179.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.087 HD21 HG22 ' A' ' 57' ' ' VAL . 7.0 tp -69.04 -44.74 72.06 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.554 -179.29 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt -59.88 -58.25 9.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.777 0.322 . . . . 0.0 111.544 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 13.0 ptmt -54.31 -27.81 38.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.22 -179.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.428 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 1.7 tptp -67.63 -25.98 66.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.057 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 44' ' ' LEU . 7.2 mt -77.1 -34.01 21.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 120.86 0.362 . . . . 0.0 110.48 179.672 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -66.6 -30.81 71.18 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.385 179.391 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.8 pt-20 -78.01 -29.45 49.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.477 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.859 HD11 HG21 ' A' ' 53' ' ' VAL . 14.6 mt -58.82 154.27 15.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.941 -179.92 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -102.78 -98.84 2.46 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.584 179.971 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -152.31 97.41 0.17 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.523 -180.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 84.8 147.15 8.54 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.449 179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 97.26 -94.23 1.54 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.531 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -65.75 -15.92 63.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.673 0.273 . . . . 0.0 111.267 179.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.754 HG11 HG22 ' A' ' 4' ' ' VAL . 21.5 t -68.29 -19.7 24.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.445 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mttm -76.94 -26.48 54.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.331 -179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.03 -57.14 3.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.339 . . . . 0.0 110.591 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.859 HG21 HD11 ' A' ' 44' ' ' LEU . 21.3 t -54.04 -31.98 22.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.282 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -59.17 -38.99 81.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.983 0.42 . . . . 0.0 110.616 179.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -71.88 -27.69 63.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.743 179.631 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -67.1 -28.62 68.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.079 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.087 HG22 HD21 ' A' ' 37' ' ' LEU . 11.0 t -82.38 -25.6 8.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.037 -179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.19 60.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.466 -179.619 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.19 -40.48 52.25 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -178.919 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.709 HD11 ' O ' ' A' ' 30' ' ' LEU . 1.1 tt -77.0 -24.83 52.2 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.23 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.69 -54.63 11.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.02 0.438 . . . . 0.0 110.483 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -63.61 -26.96 68.92 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.961 179.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.595 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.9 tm-20 -61.27 -58.71 7.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.048 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.573 HD13 HG22 ' A' ' 18' ' ' VAL . 32.1 mt -54.08 -27.04 15.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.197 179.843 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -32.9 74.36 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.872 -179.814 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.92 -56.73 6.27 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.701 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.766 HD22 ' CG ' ' A' ' 26' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.296 -0.859 . . . . 0.0 110.953 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.62 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.186 0 N-CA-C 112.477 -0.249 . . . . 0.0 112.477 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.0 m -113.28 140.3 48.11 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.837 0.351 . . . . 0.0 110.836 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.76 -55.69 0.18 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.86 179.99 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.972 HG22 HG21 ' A' ' 50' ' ' VAL . 21.2 t -83.1 -32.21 9.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.126 -179.846 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -58.05 -33.53 69.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.943 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.77 -25.86 34.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.16 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.482 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.1 tt -63.38 -30.02 71.23 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.047 -179.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.02 -33.7 68.26 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.263 -179.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -77.25 -19.94 55.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.473 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -45.52 65.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.46 -179.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.669 HG22 HG13 ' A' ' 57' ' ' VAL . 22.0 t -78.38 -29.18 14.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.661 -179.394 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.52 -35.6 81.01 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.141 179.904 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.43 -26.59 35.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.476 0.655 . . . . 0.0 109.62 178.711 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.626 ' O ' HD23 ' A' ' 14' ' ' LEU . 4.0 tt -64.38 -25.39 68.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.895 -1.048 . . . . 0.0 110.913 179.557 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -77.86 -45.51 24.06 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -52.0 -26.82 11.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.841 0.353 . . . . 0.0 110.907 179.903 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 -48.6 19.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.984 -179.973 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.655 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.3 t -70.9 -56.04 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 -179.841 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.58 -20.49 8.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.416 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.05 -16.01 27.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.633 -179.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.762 HD11 HG21 ' A' ' 27' ' ' ILE . 1.5 pp -100.44 -36.92 9.04 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.764 0.316 . . . . 0.0 111.002 -179.86 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.59 -146.53 18.84 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.76 179.79 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.61 156.39 26.97 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.548 -179.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 141.36 126.53 2.2 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.578 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.96 -130.35 33.08 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.492 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.434 ' HG2' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -53.4 -27.84 26.45 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.763 0.316 . . . . 0.0 111.094 -179.915 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.762 HG21 HD11 ' A' ' 21' ' ' LEU . 16.7 mt -68.79 -29.64 44.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.442 -179.485 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -63.91 -56.07 17.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.527 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -55.95 -26.9 50.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.801 0.334 . . . . 0.0 111.219 -179.722 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.691 HD22 ' HG ' ' A' ' 60' ' ' LEU . 56.1 mt -81.09 -21.14 40.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.785 -179.45 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 tttt -74.43 -54.42 7.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.722 -179.39 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -54.55 -52.11 63.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.752 0.311 . . . . 0.0 111.761 -179.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.485 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 2.9 ttpp -66.69 -25.08 66.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.924 -179.408 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -60.75 -57.68 11.66 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.067 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.516 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.1 OUTLIER -66.99 -56.16 11.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.127 -178.593 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.516 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 20.3 tt0 -47.85 -28.5 2.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 111.348 -179.688 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.04 HD21 HG22 ' A' ' 57' ' ' VAL . 6.2 tp -68.99 -38.68 79.45 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.472 -179.459 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.2 mtpp -66.38 -58.26 5.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.399 -179.553 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.1 ptmt -52.19 -28.02 16.75 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.449 -179.629 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 48.6 tttm -69.34 -25.91 64.44 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.165 -179.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.8 mt -77.8 -34.91 20.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.932 0.396 . . . . 0.0 110.734 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -67.93 -29.67 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 179.719 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.49 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -78.5 -30.89 47.45 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.096 0.474 . . . . 0.0 110.575 179.734 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.718 HD21 ' HG2' ' A' ' 49' ' ' GLU . 8.5 mt -59.33 167.86 1.7 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.869 179.985 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -145.98 -47.02 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.388 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.47 -176.3 41.69 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.688 -0.767 . . . . 0.0 112.447 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 107.86 -119.76 5.85 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.492 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -131.2 18.54 4.98 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.62 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.718 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.2 tt0 -95.13 -25.83 16.26 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.781 0.324 . . . . 0.0 110.922 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.972 HG21 HG22 ' A' ' 4' ' ' VAL . 14.8 p -53.05 -30.17 16.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.281 -179.904 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 1.1 mttm -67.64 -38.57 84.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.018 -179.964 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.6 tptm -60.18 -57.19 13.89 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.993 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.705 HG21 HD11 ' A' ' 44' ' ' LEU . 21.4 t -56.78 -25.87 22.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.304 179.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.471 ' HG2' HD11 ' A' ' 7' ' ' LEU . 0.3 OUTLIER -65.72 -38.53 89.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.883 0.373 . . . . 0.0 110.592 179.853 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -71.36 -27.86 63.65 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.804 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mt-10 -70.62 -28.9 65.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.06 -179.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.04 HG22 HD21 ' A' ' 37' ' ' LEU . 23.0 t -83.12 -25.82 7.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.133 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.42 -28.49 59.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.668 -179.538 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.84 -40.52 63.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.875 -178.992 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.691 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.18 -25.83 47.36 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.238 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -71.79 -40.05 69.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.945 0.403 . . . . 0.0 110.794 -179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -76.38 -26.88 56.09 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.272 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.613 ' OE1' HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -63.87 -59.11 4.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.153 -179.68 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.752 HG23 HD11 ' A' ' 67' ' ' LEU . 35.3 mt -51.87 -26.48 7.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.236 -179.894 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.14 -31.65 69.16 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.77 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.6 mtmm -70.77 -57.38 4.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.766 179.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.752 HD11 HG23 ' A' ' 64' ' ' ILE . 4.2 pp . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.014 -179.957 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.655 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.551 -0.22 . . . . 0.0 112.551 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.1 t -160.6 122.33 3.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.806 0.336 . . . . 0.0 110.905 -179.962 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.67 -58.97 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.852 -179.927 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.413 HG11 ' O ' ' A' ' 45' ' ' GLY . 9.4 p -71.32 -27.97 30.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.106 -179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.61 -36.73 69.76 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.837 179.882 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.406 ' HA ' ' HG2' ' A' ' 9' ' ' GLU . . . -74.69 -25.81 59.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.998 179.787 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.428 HD22 HD13 ' A' ' 41' ' ' ILE . 0.8 OUTLIER -68.07 -28.43 67.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.153 -179.969 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -76.47 -31.84 58.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.489 -179.536 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 6' ' ' ALA . 0.1 OUTLIER -77.29 -23.92 51.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.552 -179.682 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -55.2 14.4 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.845 0.355 . . . . 0.0 111.338 -179.393 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.698 HG22 HG13 ' A' ' 57' ' ' VAL . 21.7 t -70.03 -28.96 38.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.519 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.0 -36.14 78.69 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.463 -179.952 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.33 -24.42 39.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.513 0.673 . . . . 0.0 109.445 178.67 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.563 HD21 HD23 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -66.15 -25.22 66.87 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.852 -1.067 . . . . 0.0 110.938 179.361 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.444 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 31.4 tt0 -70.7 -47.04 61.86 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.24 -179.373 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -50.05 -26.58 4.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.837 0.351 . . . . 0.0 111.216 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 21' ' ' LEU . 0.1 OUTLIER -76.1 -43.74 41.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.536 -179.775 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.6 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.7 t -78.13 -43.48 27.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.409 -179.498 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.7 mtpt -49.79 -36.52 26.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.028 0.442 . . . . 0.0 110.737 179.777 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.47 -10.95 35.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.795 179.294 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 1.024 HD21 HD12 ' A' ' 67' ' ' LEU . 4.8 tp -72.51 -46.9 52.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.105 -179.56 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.537 ' O ' HG21 ' A' ' 27' ' ' ILE . . . 110.92 -137.66 14.45 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.596 179.915 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -160.34 178.35 36.41 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.488 -179.983 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 148.06 -77.47 0.24 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.528 -179.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -128.31 -88.76 0.59 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.504 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.944 ' HG3' HD22 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.41 -27.89 64.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.845 0.355 . . . . 0.0 110.988 -179.983 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.537 HG21 ' O ' ' A' ' 22' ' ' GLY . 44.1 mt -73.37 -29.83 28.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.13 -179.793 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -65.68 -56.18 13.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.586 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -59.03 -36.03 74.28 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.865 0.364 . . . . 0.0 111.281 -179.508 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.712 HD22 ' HG ' ' A' ' 60' ' ' LEU . 96.6 mt -70.7 -21.62 62.55 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.833 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.47 -57.25 4.0 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -179.274 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -54.83 -42.33 71.79 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -179.217 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.415 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -73.26 -25.45 60.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.638 -179.502 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.12 -57.81 10.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.938 0.399 . . . . 0.0 111.913 -179.167 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -66.37 -53.22 38.52 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.929 -178.801 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.49 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 11.2 tt0 -49.21 -28.55 4.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 111.176 -179.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.979 HD21 HG22 ' A' ' 57' ' ' VAL . 4.2 tp -71.44 -38.79 71.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.501 -179.522 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -58.34 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.73 -179.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -51.43 -28.13 12.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.476 -179.512 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.415 ' CD ' HG22 ' A' ' 53' ' ' VAL . 0.0 OUTLIER -69.44 -28.66 66.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.974 -179.876 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 HD22 ' A' ' 7' ' ' LEU . 7.2 mt -75.77 -31.92 23.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.896 0.379 . . . . 0.0 110.506 179.707 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -68.1 -31.88 71.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.385 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -75.8 -29.75 58.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.421 179.496 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.896 HD11 HG21 ' A' ' 53' ' ' VAL . 14.1 mt -66.7 179.29 1.09 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.982 179.971 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.413 ' O ' HG11 ' A' ' 4' ' ' VAL . . . -134.07 -74.61 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.544 179.997 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.89 109.24 0.3 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.441 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.49 ' H ' HG21 ' A' ' 50' ' ' VAL . . . 79.82 170.0 39.8 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.466 -179.951 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 79.88 -106.86 2.51 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.397 -179.987 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.49 -24.31 67.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.706 0.288 . . . . 0.0 111.038 179.988 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.49 HG21 ' H ' ' A' ' 47' ' ' GLY . 21.5 t -54.2 -24.1 11.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.397 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -66.74 -36.75 83.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.938 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -70.65 -57.11 5.05 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.878 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 44' ' ' LEU . 20.6 t -50.24 -26.34 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.465 -179.931 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -65.2 -32.67 74.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.536 179.789 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.28 -27.95 47.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.725 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -68.66 -28.87 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.797 179.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.979 HG22 HD21 ' A' ' 37' ' ' LEU . 30.9 t -83.14 -25.54 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.811 179.875 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.3 mttt -74.04 -28.1 61.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.51 -179.609 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -39.41 63.61 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -179.041 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.712 ' HG ' HD22 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -78.0 -25.75 48.18 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.165 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -46.59 64.47 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.949 0.404 . . . . 0.0 110.88 -179.86 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -71.79 -26.98 62.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.416 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.616 ' CB ' HD21 ' A' ' 30' ' ' LEU . 1.3 mm-40 -62.71 -59.18 5.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.031 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.45 HG12 HD13 ' A' ' 30' ' ' LEU . 38.1 mt -51.22 -28.13 7.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.289 179.957 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -29.76 68.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.05 -179.966 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.5 mttm -69.38 -38.44 78.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.097 -179.905 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 1.024 HD12 HD21 ' A' ' 21' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.178 -0.915 . . . . 0.0 110.946 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.6 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.168 0 N-CA-C 112.523 -0.231 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -157.88 32.71 0.26 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.864 -179.963 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.2 mtt180 -142.3 -56.01 0.44 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.906 179.953 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 11.6 p -63.33 -22.88 31.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.351 179.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -55.72 -38.48 69.8 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -179.95 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.19 -25.94 39.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.308 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.638 HD21 HG21 ' A' ' 57' ' ' VAL . 1.0 OUTLIER -64.24 -27.28 68.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.062 -179.989 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -74.3 -33.23 63.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.137 -179.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.19 -20.11 55.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.357 -179.817 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.77 -43.13 38.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.333 -179.559 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.658 HG12 ' HE2' ' A' ' 38' ' ' LYS . 21.9 t -74.62 -29.06 22.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.706 -179.568 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -36.43 81.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.018 0.437 . . . . 0.0 110.352 179.794 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.35 -23.85 37.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.548 0.689 . . . . 0.0 109.514 178.518 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.615 HD21 HD23 ' A' ' 60' ' ' LEU . 0.4 OUTLIER -66.64 -25.06 66.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.773 -1.103 . . . . 0.0 111.054 179.527 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.418 ' HA ' ' C3 ' ' A' ' 101' ' ' HTS . 54.0 tt0 -76.33 -50.63 13.79 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.309 -179.463 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -51.7 -26.18 8.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.783 0.325 . . . . 0.0 111.074 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.21 -41.55 49.06 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.677 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 11.7 t -78.14 -51.81 17.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.19 -179.979 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.5 -31.6 10.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.464 -179.649 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.96 -10.84 37.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.52 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.727 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -67.81 -69.46 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.823 0.344 . . . . 0.0 110.987 -179.932 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 137.45 -127.43 3.96 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.446 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -152.61 -177.94 26.75 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.538 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 145.61 -42.68 0.96 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.494 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 167.32 -65.58 0.19 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.437 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -37.53 77.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.897 0.38 . . . . 0.0 110.932 179.833 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.67 HG12 HD13 ' A' ' 21' ' ' LEU . 4.0 mt -71.19 -29.5 36.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.526 -179.74 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -62.25 -56.21 20.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.7 -179.363 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.1 -51.29 70.33 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.959 0.409 . . . . 0.0 111.466 -179.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.743 ' O ' HD11 ' A' ' 60' ' ' LEU . 96.1 mt -58.4 -21.09 49.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.122 -179.128 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttt -74.09 -59.04 2.91 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 111.96 0.355 . . . . 0.0 111.96 -178.965 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.29 -45.41 62.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.927 -179.234 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.417 ' HB3' ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -72.23 -24.93 61.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.222 -0.445 . . . . 0.0 112.024 -179.167 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.16 -57.86 9.13 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.694 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.79 -44.21 81.9 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.936 -178.644 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.41 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -56.79 -28.03 60.73 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.105 0.479 . . . . 0.0 110.889 179.997 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.062 HD21 HG22 ' A' ' 57' ' ' VAL . 7.1 tp -71.34 -41.7 69.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.287 -179.505 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.658 ' HE2' HG12 ' A' ' 11' ' ' VAL . 20.6 mttm -58.64 -58.3 9.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.675 -179.575 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 13.8 pttt -51.64 -27.77 12.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.685 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.411 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 22.8 tttp -73.61 -25.8 60.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.459 -179.562 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 7.5 mt -76.27 -39.11 34.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.682 0.277 . . . . 0.0 111.239 -179.81 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -63.92 -31.57 72.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 110.488 179.666 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.46 -30.94 60.11 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.485 179.609 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.814 HD11 HG21 ' A' ' 53' ' ' VAL . 11.7 mt -60.12 172.36 0.82 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.988 179.976 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.64 -61.36 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.548 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 160.18 82.02 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.566 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -146.7 -125.3 1.64 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.445 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -108.18 -1.74 33.58 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.692 -0.765 . . . . 0.0 112.842 179.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -95.06 -23.39 17.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.799 0.333 . . . . 0.0 111.057 179.931 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -51.9 -30.27 12.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.373 -179.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -29.12 65.9 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.082 -179.986 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -68.87 -57.24 5.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.984 -179.812 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.814 HG21 HD11 ' A' ' 44' ' ' LEU . 12.0 t -57.12 -26.91 26.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.084 -179.95 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -64.34 -36.1 83.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.62 179.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -73.89 -27.92 61.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.768 179.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -69.44 -29.0 66.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.082 179.97 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.062 HG22 HD21 ' A' ' 37' ' ' LEU . 16.5 t -83.24 -25.71 7.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.066 179.935 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.9 mttt -75.11 -28.26 60.17 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.704 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -39.93 61.76 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.907 0.336 . . . . 0.0 111.907 -179.132 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.743 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.4 OUTLIER -78.17 -25.73 47.36 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -178.996 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.65 -49.45 47.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.002 0.429 . . . . 0.0 110.644 -179.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -69.06 -26.68 65.08 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.099 179.855 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.588 ' CB ' HD21 ' A' ' 30' ' ' LEU . 0.2 OUTLIER -62.0 -56.33 20.18 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 -179.632 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.664 HG12 HD13 ' A' ' 30' ' ' LEU . 25.7 mt -57.03 -25.87 23.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.264 179.969 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -62.58 -31.24 72.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.878 -179.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -69.98 -60.97 1.97 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.831 179.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.727 ' CD1' HD11 ' A' ' 21' ' ' LEU . 1.6 pp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.026 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.677 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.167 0 N-CA-C 112.517 -0.233 . . . . 0.0 112.517 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -129.54 58.42 1.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.962 0.41 . . . . 0.0 110.831 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.79 -43.95 2.1 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.875 -179.943 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.454 HG22 HG11 ' A' ' 50' ' ' VAL . 21.3 t -66.39 -34.73 72.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.112 179.962 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.2 mttm -57.57 -33.93 68.68 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.688 179.832 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.79 -25.46 56.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.011 179.759 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.06 -29.14 66.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.09 -179.845 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HG2' HG21 ' A' ' 41' ' ' ILE . 80.0 mt-10 -79.63 -39.91 30.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.276 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.38 -19.78 63.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.106 -179.946 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.08 -46.75 67.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.069 -179.689 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.483 HG22 ' CG1' ' A' ' 57' ' ' VAL . 21.3 t -71.89 -29.06 32.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.604 -179.711 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.03 -36.64 80.07 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.563 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.33 -24.53 37.08 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.589 0.709 . . . . 0.0 109.712 178.747 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.552 HD21 HD23 ' A' ' 60' ' ' LEU . 1.8 tt -65.9 -25.07 66.99 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.965 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.458 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -75.67 -41.05 54.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.388 -179.273 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -54.98 -28.12 49.26 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.307 -179.856 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -48.42 20.44 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.487 -179.688 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.667 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 3.7 t -69.71 -47.77 68.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.491 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.458 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 4.3 mtpm? -51.43 -28.76 13.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.232 -179.71 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.11 -10.95 37.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.292 179.84 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.485 HD13 ' HA ' ' A' ' 21' ' ' LEU . 0.0 OUTLIER -73.21 -159.69 0.07 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.832 -179.76 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.485 ' H ' HD13 ' A' ' 27' ' ' ILE . . . -116.65 -118.21 3.01 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.545 179.933 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 174.75 176.05 42.75 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.52 179.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 139.62 -28.29 2.55 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.53 179.995 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 173.47 -65.12 0.12 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.416 -179.998 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.601 ' CD ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -56.51 -62.11 1.95 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.955 0.407 . . . . 0.0 110.942 179.872 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.607 HG13 HD22 ' A' ' 67' ' ' LEU . 7.2 mt -60.48 -29.76 45.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.524 -179.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.15 -56.14 26.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.772 0.32 . . . . 0.0 111.263 -179.632 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -58.83 -30.83 67.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.974 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.952 HD23 ' HG ' ' A' ' 60' ' ' LEU . 3.4 mt -70.57 -21.8 62.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.053 -0.522 . . . . 0.0 111.385 -179.873 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.8 tttt -78.6 -59.32 2.83 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.134 0.42 . . . . 0.0 112.134 -178.944 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 mttt -53.05 -36.72 60.91 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.776 0.322 . . . . 0.0 111.828 -179.041 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.743 ' HE3' HD12 ' A' ' 60' ' ' LEU . 7.4 ttpp -82.04 -24.99 35.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.991 -179.321 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -63.68 -57.81 8.86 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 -178.532 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -42.29 84.12 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.528 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -58.89 -28.16 65.9 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.013 0.435 . . . . 0.0 110.995 -179.812 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.002 HD21 HG22 ' A' ' 57' ' ' VAL . 2.9 tp -70.41 -47.0 62.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.52 -179.244 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.16 -58.17 9.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.82 0.343 . . . . 0.0 111.411 -179.395 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.68 -27.92 13.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.441 -179.714 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.416 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 5.3 tttp -69.87 -29.6 66.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.036 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' A' ' 8' ' ' GLU . 8.5 mt -75.11 -31.79 25.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.756 179.774 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -31.44 69.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.494 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.486 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -75.89 -29.9 58.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.574 179.667 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.52 HD11 ' CG2' ' A' ' 53' ' ' VAL . 7.4 mt -62.36 159.45 15.26 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.894 -179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.77 -77.16 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.49 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -145.69 161.51 28.24 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.449 179.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 115.88 -161.03 13.03 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.457 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -98.76 24.36 32.47 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.644 179.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.419 ' HG2' HD21 ' A' ' 44' ' ' LEU . 3.8 tt0 -88.95 -27.09 21.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.795 0.331 . . . . 0.0 111.024 179.944 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.454 HG11 HG22 ' A' ' 4' ' ' VAL . 21.4 t -55.63 -23.2 14.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.415 179.938 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 23.2 tttt -72.9 -32.47 65.37 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.943 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 13.8 tptm -65.93 -57.17 8.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.837 -179.969 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.53 ' O ' HG23 ' A' ' 57' ' ' VAL . 21.7 t -57.8 -28.05 31.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.119 179.883 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -63.67 -40.96 98.15 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.945 0.402 . . . . 0.0 110.617 179.812 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -68.67 -27.86 66.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.784 179.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -70.26 -28.76 65.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.028 179.997 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.002 HG22 HD21 ' A' ' 37' ' ' LEU . 12.2 t -82.11 -25.81 9.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.86 -179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -75.18 -28.64 60.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.259 -179.731 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.27 -37.48 60.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.613 -179.229 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.952 ' HG ' HD23 ' A' ' 30' ' ' LEU . 4.2 tt -76.59 -27.69 55.88 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.086 -0.246 . . . . 0.0 111.405 -179.546 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -66.64 -56.18 11.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.051 0.453 . . . . 0.0 110.49 179.868 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -62.65 -26.87 68.85 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.821 179.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.826 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -60.91 -44.54 97.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.956 -179.92 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 13.9 mt -67.35 -24.26 31.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-O 120.903 0.382 . . . . 0.0 110.885 179.505 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -33.87 76.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.862 -179.848 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -62.32 -62.77 1.53 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.769 179.925 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.616 HD21 ' CD1' ' A' ' 30' ' ' LEU . 1.1 pp . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.667 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.489 -0.244 . . . . 0.0 112.489 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.6 t -114.71 103.37 10.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.852 0.358 . . . . 0.0 110.817 -179.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.67 -31.51 69.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.927 -179.97 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.487 HG12 HG22 ' A' ' 41' ' ' ILE . 14.6 t -69.41 -40.11 79.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.017 -179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 tttt -56.27 -32.61 64.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.708 179.919 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.88 -25.82 48.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.895 179.783 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -28.12 67.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.239 -179.961 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.445 ' HG3' HG21 ' A' ' 41' ' ' ILE . 84.1 mt-10 -77.2 -33.62 56.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.405 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.22 -24.58 59.35 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.104 -179.788 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -70.42 -52.0 25.44 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.913 -179.946 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.503 HG22 ' CG1' ' A' ' 57' ' ' VAL . 26.1 t -63.65 -29.22 46.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.247 -179.976 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.95 -38.21 70.04 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.979 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.55 -28.85 46.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.544 0.688 . . . . 0.0 109.485 178.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.712 ' O ' HD23 ' A' ' 14' ' ' LEU . 3.8 tt -59.75 -25.22 64.69 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.812 179.121 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.438 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 33.6 tt0 -77.73 -43.52 30.68 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.305 -179.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -52.28 -30.98 30.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.179 -179.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 11.2 tttt -76.06 -37.23 58.51 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.294 -179.835 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.663 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 20.2 t -78.1 -53.46 14.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.626 -179.594 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.438 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.8 OUTLIER -49.77 -30.11 8.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.499 -179.468 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.8 -12.88 37.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.436 -179.898 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.732 HD11 HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -65.34 -69.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.014 -179.984 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 159.55 -95.73 0.14 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.484 -179.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.407 ' N ' HD13 ' A' ' 27' ' ' ILE . . . 150.35 135.24 2.37 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.501 179.961 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 122.47 117.69 2.43 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.483 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.94 -123.42 6.53 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.554 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.735 ' HG2' HD13 ' A' ' 67' ' ' LEU . 0.2 OUTLIER -58.5 -27.58 64.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.824 0.345 . . . . 0.0 111.062 -179.981 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.41 HG12 HD13 ' A' ' 21' ' ' LEU . 37.5 mt -70.74 -29.56 38.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.499 -179.597 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -64.07 -56.27 16.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.815 -179.156 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -59.73 -38.66 82.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.824 0.345 . . . . 0.0 111.348 -179.4 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.71 ' O ' HD11 ' A' ' 60' ' ' LEU . 80.0 mt -67.78 -21.37 65.25 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.841 -179.369 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.54 -59.16 2.89 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.08 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -52.59 -43.16 65.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.724 0.297 . . . . 0.0 111.778 -179.279 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.826 ' HE2' HD12 ' A' ' 60' ' ' LEU . 7.1 ttpt -74.73 -24.95 58.81 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.908 -179.288 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -63.17 -57.98 8.73 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 -178.746 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -69.81 -51.33 34.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.814 -178.709 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.462 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 2.7 tt0 -50.86 -28.24 9.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.117 0.484 . . . . 0.0 110.884 179.904 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.042 HD21 HG22 ' A' ' 57' ' ' VAL . 9.6 tp -70.26 -41.81 72.98 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.424 -179.496 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.07 -58.23 9.24 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.647 -179.301 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -52.97 -27.77 20.65 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.347 -179.72 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 3.7 tppp? -70.46 -25.67 63.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.194 -179.831 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.487 HG22 HG12 ' A' ' 4' ' ' VAL . 7.5 mt -76.71 -36.95 27.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.785 0.326 . . . . 0.0 111.083 -179.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -67.95 -29.63 68.73 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.764 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.452 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -77.66 -29.95 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.15 0.5 . . . . 0.0 110.551 179.552 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.545 HD21 ' HG2' ' A' ' 49' ' ' GLU . 4.2 mt -53.47 162.34 0.82 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.152 -179.976 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -142.75 -102.98 0.45 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.455 -179.927 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -132.94 -176.74 14.53 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.533 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 98.44 -116.41 5.55 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.413 179.938 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -141.85 27.15 2.33 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.506 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG2' HD21 ' A' ' 44' ' ' LEU . 4.8 tt0 -90.63 -28.08 18.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.822 0.344 . . . . 0.0 111.009 179.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.1 -20.26 17.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.469 -179.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -32.16 64.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.756 0.312 . . . . 0.0 111.215 -179.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.2 ttpp -67.95 -57.3 6.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.895 -179.846 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.557 ' O ' HG23 ' A' ' 57' ' ' VAL . 51.4 t -58.99 -25.98 31.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.044 179.959 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.56 -37.99 88.28 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.504 179.798 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -71.31 -28.77 64.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.684 179.722 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.66 -28.89 66.26 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.977 179.912 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.042 HG22 HD21 ' A' ' 37' ' ' LEU . 18.7 t -83.06 -25.69 8.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.013 179.973 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.04 -28.36 60.41 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.568 -179.606 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -38.73 58.11 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -179.078 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.826 HD12 ' HE2' ' A' ' 33' ' ' LYS . 1.0 OUTLIER -77.58 -25.55 50.06 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.256 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -70.13 -54.99 10.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.01 0.433 . . . . 0.0 110.509 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.8 -26.92 68.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.125 179.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.526 ' CG ' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.45 -59.11 5.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.17 -179.666 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.539 HD13 HG22 ' A' ' 18' ' ' VAL . 36.6 mt -52.73 -27.45 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.387 179.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.4 mptt -64.75 -29.87 70.86 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.916 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -75.08 -31.04 61.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.017 -179.925 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.735 HD13 ' HG2' ' A' ' 26' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.894 179.953 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.663 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.134 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 t -59.45 -26.98 65.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.803 0.335 . . . . 0.0 111.06 179.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 3.0 mmt85 -57.21 -57.27 13.34 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.064 179.974 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.4 t -73.49 -37.66 50.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.2 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 20.8 mttt -57.06 -32.93 66.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.89 179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.06 -25.91 31.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.166 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.652 HD21 HG21 ' A' ' 57' ' ' VAL . 0.9 OUTLIER -65.75 -27.79 68.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.744 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.42 ' HG3' HG21 ' A' ' 41' ' ' ILE . 32.1 mt-10 -78.67 -38.34 39.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.458 -179.452 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.51 -19.86 62.13 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.534 -179.633 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -73.06 -53.7 10.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.273 -179.734 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.416 HG22 HG13 ' A' ' 57' ' ' VAL . 21.8 t -63.89 -29.31 46.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.72 -179.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.0 tttm -58.57 -37.06 74.95 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.727 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.22 -23.91 40.58 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.582 0.706 . . . . 0.0 109.463 178.73 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.616 HD21 HD23 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -65.23 -25.22 67.59 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.946 179.36 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.42 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 29.8 tt0 -74.24 -42.1 60.24 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.96 -0.563 . . . . 0.0 111.117 -179.38 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -56.81 -26.02 57.15 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.176 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.11 -51.88 11.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.432 -179.768 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.674 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 8.5 t -68.12 -47.79 76.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.446 -179.697 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.42 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 2.5 mtpt -50.81 -27.16 6.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.327 -179.704 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.13 -10.86 37.36 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.533 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.996 HD11 HD13 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.19 -157.49 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.667 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.431 ' H ' HD22 ' A' ' 21' ' ' LEU . . . 138.33 135.99 3.38 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.47 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.02 95.75 1.98 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.556 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.57 179.16 16.94 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.507 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.53 -31.52 4.24 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.461 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -27.64 66.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.814 0.34 . . . . 0.0 111.023 179.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.641 HG12 HD13 ' A' ' 21' ' ' LEU . 23.8 mt -68.55 -29.67 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.459 -179.537 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -63.96 -56.15 17.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.64 -179.352 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -61.18 -30.43 70.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.836 0.351 . . . . 0.0 111.281 -179.497 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.729 ' O ' HD11 ' A' ' 60' ' ' LEU . 95.0 mt -73.6 -21.35 60.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.491 -179.604 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.7 ttmt -78.06 -59.4 2.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.728 -179.345 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -33.59 59.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.793 0.33 . . . . 0.0 111.566 -179.352 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.9 OUTLIER -81.96 -24.89 35.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.813 -179.521 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.425 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -65.71 -58.05 6.59 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -178.766 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.9 -41.94 74.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.878 -178.832 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.5 -28.27 66.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.037 0.446 . . . . 0.0 110.789 -179.979 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.098 HD21 HG22 ' A' ' 57' ' ' VAL . 3.8 tp -70.26 -40.75 74.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.461 -179.41 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.5 mtmt -61.72 -58.32 8.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.599 -179.462 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.8 ptmt -50.59 -28.27 8.38 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.559 -179.601 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.4 OUTLIER -69.79 -28.42 65.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.87 -179.995 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.42 HG21 ' HG3' ' A' ' 8' ' ' GLU . 7.3 mt -76.2 -30.26 20.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.586 179.579 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -68.89 -33.34 73.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.244 179.468 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.494 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -74.5 -30.61 61.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.342 179.61 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.909 HD11 HG21 ' A' ' 53' ' ' VAL . 13.3 mt -61.25 168.75 2.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.843 179.953 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -138.85 -95.53 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.545 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -86.29 -142.98 7.07 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.471 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -90.58 -175.97 44.44 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.562 179.914 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 101.76 -82.88 0.47 Allowed Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.497 -179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.431 ' HG2' HD21 ' A' ' 44' ' ' LEU . 1.4 tp10 -66.4 -15.04 62.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.634 0.254 . . . . 0.0 111.246 179.935 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 21.8 t -58.32 -18.85 12.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.625 -179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -74.65 -29.88 61.41 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.717 0.294 . . . . 0.0 111.201 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttt -78.0 -57.37 3.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.089 -179.782 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.909 HG21 HD11 ' A' ' 44' ' ' LEU . 17.1 t -57.23 -25.86 24.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.29 -179.993 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -65.8 -35.17 79.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.922 0.392 . . . . 0.0 110.55 179.809 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -75.18 -27.67 59.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.739 179.738 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.9 mt-10 -69.29 -30.77 68.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.115 -179.827 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.098 HG22 HD21 ' A' ' 37' ' ' LEU . 9.6 t -83.3 -25.57 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.183 -179.958 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.98 -27.97 60.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.579 -179.524 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? -76.06 -39.54 55.23 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -178.943 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.729 HD11 ' O ' ' A' ' 30' ' ' LEU . 0.6 OUTLIER -77.97 -25.26 48.03 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -179.273 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -52.74 19.04 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.05 0.452 . . . . 0.0 110.715 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -66.5 -26.92 67.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.225 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.678 ' OE1' HD11 ' A' ' 30' ' ' LEU . 1.4 tm-20 -61.89 -56.12 22.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.024 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.665 HG23 HD11 ' A' ' 67' ' ' LEU . 30.0 mt -56.15 -26.8 22.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.045 179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -34.22 75.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.81 179.922 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.7 mmtt -67.2 -59.74 3.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.606 179.854 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.996 HD13 HD11 ' A' ' 21' ' ' LEU . 3.7 pp . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.019 179.819 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.674 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 112.415 -0.274 . . . . 0.0 112.415 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.3 t -128.8 -64.67 0.91 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.844 0.354 . . . . 0.0 110.907 -179.997 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.86 -65.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.868 -179.991 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.427 HG22 HG11 ' A' ' 50' ' ' VAL . 21.5 t -63.38 -29.46 47.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.217 179.979 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 8.3 ttmt -57.0 -35.78 69.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.958 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.04 -25.96 31.63 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.102 179.837 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 7' ' ' LEU . 1.3 tt -62.67 -27.74 69.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.03 179.989 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -73.87 -32.99 63.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.249 -179.778 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.17 -20.21 55.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.341 -179.84 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.32 -51.13 48.05 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.894 0.378 . . . . 0.0 111.101 -179.732 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.498 HG22 HG13 ' A' ' 57' ' ' VAL . 24.4 t -72.7 -29.19 29.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.44 -179.783 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt -61.44 -36.57 80.76 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.406 179.985 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.26 -24.01 37.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.499 0.666 . . . . 0.0 109.56 178.623 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.503 HD21 HD23 ' A' ' 60' ' ' LEU . 1.0 OUTLIER -66.01 -25.21 66.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.883 179.403 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.405 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.2 tt0 -75.36 -47.78 26.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.221 -179.585 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -50.25 -28.23 7.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.157 -179.826 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -76.11 -41.71 49.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.342 179.999 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.627 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 2.5 t -75.46 -55.08 12.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.422 -179.705 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.405 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 6.0 mtpt -50.82 -29.33 11.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.357 -179.661 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -92.08 -11.68 35.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.4 179.953 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.64 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -68.49 -69.64 0.31 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.928 -179.965 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.39 -131.53 3.52 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.492 -179.965 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.53 136.28 6.61 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.437 -179.957 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 178.18 -171.52 43.95 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.556 179.979 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -60.19 -70.55 0.97 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.481 -179.948 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.779 ' NE ' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -55.1 -27.82 47.92 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.836 0.351 . . . . 0.0 111.102 -179.913 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 71.4 mt -76.25 -29.58 19.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.291 -179.604 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -68.39 -45.76 71.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.184 -179.752 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -69.19 -29.35 67.31 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.918 0.389 . . . . 0.0 110.818 179.908 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.879 HD21 ' HB3' ' A' ' 63' ' ' GLU . 24.1 mt -74.53 -21.89 59.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.293 -179.841 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.65 -59.34 2.82 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.568 0.581 . . . . 0.0 112.568 -178.878 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.8 mmtp -50.42 -56.85 9.66 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -178.647 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.618 ' HB3' HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER -63.8 -24.99 67.98 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.18 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -61.44 -57.62 11.46 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -178.659 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.498 ' HG3' ' H ' ' A' ' 36' ' ' GLU . 0.2 OUTLIER -68.96 -54.49 15.03 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.92 0.341 . . . . 0.0 111.92 -178.588 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.498 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 1.3 tt0 -47.78 -28.75 2.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.031 0.443 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.987 HD21 HG22 ' A' ' 57' ' ' VAL . 3.0 tp -69.81 -38.37 76.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.197 -179.733 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.401 ' HZ2' HG12 ' A' ' 11' ' ' VAL . 17.4 mttp -63.62 -58.2 7.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.312 -179.705 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.9 pttt -50.66 -27.95 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.29 -179.854 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -70.56 -28.43 64.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.862 179.856 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.0 mt -74.07 -31.94 31.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.99 0.424 . . . . 0.0 110.58 179.614 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -67.86 -35.83 79.23 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.327 179.516 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.464 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -71.59 -29.37 64.62 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 179.568 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.614 HD11 ' CG2' ' A' ' 53' ' ' VAL . 13.1 mt -62.98 164.35 8.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.921 -179.984 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -141.03 -99.8 0.39 Allowed Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.566 -179.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.435 ' O ' HG21 ' A' ' 50' ' ' VAL . . . -74.5 -93.97 0.13 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.587 179.989 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -136.95 -142.36 4.41 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.505 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.16 -88.87 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.535 -179.924 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -62.45 -26.18 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 111.082 179.976 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.556 HG22 HD22 ' A' ' 44' ' ' LEU . 25.1 t -54.89 -24.02 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.387 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt -71.17 -29.44 65.2 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.013 -179.985 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 38.8 tptt -71.17 -57.26 4.68 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.89 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.614 ' CG2' HD11 ' A' ' 44' ' ' LEU . 25.0 t -55.49 -27.66 21.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.302 -179.936 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -63.97 -31.84 73.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.977 0.418 . . . . 0.0 110.649 179.827 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -79.55 -27.77 41.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.902 179.883 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -68.87 -28.73 66.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.319 -179.88 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.987 HG22 HD21 ' A' ' 37' ' ' LEU . 20.9 t -83.1 -25.52 8.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.113 -179.892 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -75.15 -28.53 60.17 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.442 -179.66 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -40.46 52.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.742 -179.149 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.783 ' HG ' HD23 ' A' ' 30' ' ' LEU . 1.7 tt -76.2 -25.1 54.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.589 -179.352 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.24 -55.96 9.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.21 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -61.52 -26.79 68.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.879 ' HB3' HD21 ' A' ' 30' ' ' LEU . 0.3 OUTLIER -60.59 -50.01 75.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.992 -179.919 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.617 HG12 HD13 ' A' ' 30' ' ' LEU . 14.2 mt -68.19 -22.79 27.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.784 179.452 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -38.74 67.65 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.383 -179.717 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -93.91 -66.21 0.93 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.977 0.418 . . . . 0.0 110.733 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.779 HD23 ' NE ' ' A' ' 26' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.972 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.627 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.27 87.06 0.81 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.791 0.329 . . . . 0.0 110.903 -179.968 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.5 mtt180 -101.07 -60.39 1.53 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.958 -179.932 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 1.045 HG22 HG21 ' A' ' 50' ' ' VAL . 16.8 t -83.08 -50.54 15.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.336 -179.828 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 2.2 ptpp? -52.76 -30.48 32.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.892 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -82.55 -25.6 33.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.141 179.951 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.831 HD21 HG21 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -67.03 -29.13 68.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.391 -179.644 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.0 mt-10 -78.05 -33.48 50.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.556 -179.397 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.25 -19.8 56.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.77 0.319 . . . . 0.0 111.67 -179.743 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -47.38 23.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.796 -179.166 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.628 HG22 ' CG1' ' A' ' 57' ' ' VAL . 18.6 t -74.79 -29.12 22.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.907 -179.264 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.3 ttpp -63.25 -36.25 83.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.324 -179.941 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.52 -23.86 37.01 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.57 0.7 . . . . 0.0 109.753 178.722 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.612 HD21 HD23 ' A' ' 60' ' ' LEU . 1.6 tt -68.07 -25.12 65.19 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.211 179.842 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.414 ' CG ' ' HG3' ' A' ' 19' ' ' LYS . 26.1 tt0 -75.0 -51.88 12.5 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.495 -179.4 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -50.2 -26.98 5.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.322 -179.678 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.08 -43.87 41.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.21 179.976 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.684 ' HB ' ' H3 ' ' A' ' 101' ' ' HTS . 21.3 t -76.12 -48.12 29.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.556 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.414 ' HG3' ' CG ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -49.59 -31.7 11.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.518 -179.552 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -91.13 -11.04 39.73 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.505 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.714 HD11 ' CD1' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -71.63 -69.77 0.36 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.99 -179.869 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 163.46 -109.02 0.36 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.493 -179.943 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 159.19 123.88 0.73 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.504 -179.994 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 138.93 136.84 3.45 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.49 179.961 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.35 -109.31 2.06 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.573 179.936 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.539 ' HB3' HD23 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -58.5 -53.22 60.78 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.901 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.48 HG12 HD13 ' A' ' 21' ' ' LEU . 12.4 mt -60.21 -29.48 44.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.628 -179.473 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -59.09 -56.22 24.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.651 -179.265 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -58.45 -36.89 74.37 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.923 0.392 . . . . 0.0 111.225 -179.574 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.86 HD23 ' HG ' ' A' ' 60' ' ' LEU . 6.5 mt -66.77 -21.79 66.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.887 -179.387 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 5.9 tttm -78.63 -59.54 2.74 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.831 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.45 -37.41 56.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -178.921 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.766 ' HE2' HD12 ' A' ' 60' ' ' LEU . 5.8 ttpm? -82.25 -24.67 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.204 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.84 -57.81 7.86 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.72 0.637 . . . . 0.0 112.72 -178.494 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.21 -40.85 77.75 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.67 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.451 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 11.5 tt0 -59.74 -27.78 66.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.13 0.49 . . . . 0.0 110.659 179.869 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 1.061 HD21 HG22 ' A' ' 57' ' ' VAL . 6.8 tp -75.81 -40.02 55.76 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.681 -0.691 . . . . 0.0 111.66 -179.234 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.81 -33.23 74.78 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.842 -179.311 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 36' ' ' GLU . 4.2 ptmt -79.05 -30.45 44.05 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.058 -179.717 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.0 tttm -63.28 -26.0 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.893 179.879 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 9.3 mt -73.55 -30.08 28.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.622 179.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -69.7 -35.63 75.23 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.435 179.519 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.448 ' HG3' ' N ' ' A' ' 44' ' ' LEU . 1.1 pt-20 -71.71 -28.8 63.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.479 179.603 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.69 HD13 HG23 ' A' ' 50' ' ' VAL . 5.3 mt -57.66 -176.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.988 179.985 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -144.35 -126.35 1.93 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.535 179.995 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -68.88 -89.09 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.546 -179.99 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -142.98 -167.82 11.67 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.47 179.945 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.41 -63.03 3.07 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.716 -0.755 . . . . 0.0 112.443 179.948 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -95.04 -23.31 17.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.77 0.319 . . . . 0.0 110.989 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 1.045 HG21 HG22 ' A' ' 4' ' ' VAL . 14.4 p -54.16 -30.04 19.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.308 -179.925 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.97 -33.46 74.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.061 -179.954 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -57.29 12.65 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.864 -179.837 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.534 ' O ' HG23 ' A' ' 57' ' ' VAL . 39.7 t -55.11 -26.08 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.109 179.879 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -63.78 -34.35 77.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.025 0.441 . . . . 0.0 110.373 179.588 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -76.3 -28.16 56.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.469 179.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -67.23 -28.76 68.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.881 179.826 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 1.061 HG22 HD21 ' A' ' 37' ' ' LEU . 4.5 t -81.81 -25.42 9.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.898 179.885 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.7 -28.47 61.74 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.263 -179.852 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -74.51 -38.69 62.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.738 -179.373 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.86 ' HG ' HD23 ' A' ' 30' ' ' LEU . 3.0 tt -76.58 -26.01 54.59 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.673 0.249 . . . . 0.0 111.673 -179.343 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.36 -56.26 9.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.01 0.433 . . . . 0.0 110.289 179.82 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -61.85 -26.64 68.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.36 179.242 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.805 ' CB ' HD21 ' A' ' 30' ' ' LEU . 3.2 mm-40 -61.16 -45.0 96.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.995 -179.86 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.769 ' CG1' HD22 ' A' ' 30' ' ' LEU . 14.8 mt -68.48 -23.76 28.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.023 179.595 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -34.34 76.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.732 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.2 mtpm? -63.37 -63.54 1.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.6 179.838 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.714 ' CD1' HD11 ' A' ' 21' ' ' LEU . 3.4 pp . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.978 179.851 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 101' ' ' HTS . . . . . 0.684 ' H3 ' ' HB ' ' A' ' 18' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_