data_1pwj_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 1pwj _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -155.29 96.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.1 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.428 HG21 HD13 ' A' ' 8' ' ' ILE . 69.0 mt -79.21 112.43 17.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.948 0.404 . . . . 0.0 110.994 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -80.97 -32.36 34.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.933 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -168.45 114.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.619 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.41 ' CB ' ' NE2' ' A' ' 18' ' ' GLN . . . -112.49 117.96 33.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.452 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.87 -13.68 18.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.844 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.502 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 41.9 tpp -75.32 170.91 15.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.377 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.0 t -73.38 38.01 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.535 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 92.0 mt-10 68.65 -43.91 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -45.39 -40.22 7.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.619 0.247 . . . . 0.0 111.64 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.502 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -71.91 -26.42 62.3 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.16 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.535 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 60.9 mt-30 -64.79 -42.62 94.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -77.09 -40.13 47.14 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.183 178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -70.98 -57.67 4.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.379 . . . . 0.0 110.907 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.428 ' CB ' ' CE2' ' A' ' 76' ' ' PHE . . . -55.21 -49.83 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.534 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.493 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 61.3 t -57.66 -44.82 86.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.352 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -73.96 -30.63 62.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 85.7 m -71.97 -32.99 67.8 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 29' ' ' MET . . . -80.93 -24.91 37.85 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.252 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.4 m -81.25 -43.83 18.63 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.995 0.426 . . . . 0.0 109.925 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -74.87 -26.27 59.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.384 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -78.56 -39.39 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.094 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 27.4 ptt? -77.21 -26.86 53.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.482 ' OE2' ' HB2' ' A' ' 31' ' ' LYS . 0.8 OUTLIER -87.01 -37.66 17.3 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HB2' ' OE2' ' A' ' 30' ' ' GLU . 24.3 ttmm -79.21 -28.31 42.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.203 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -146.73 176.28 9.98 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.803 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -158.04 27.49 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.173 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.464 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 35.6 mm -75.35 -13.03 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.549 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 42.9 mt-10 76.56 -54.46 0.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.036 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -74.81 -50.15 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.94 0.4 . . . . 0.0 110.572 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -56.26 -29.6 61.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.15 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.3 -56.06 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.634 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.75 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.25 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.465 ' O ' ' CB ' ' A' ' 44' ' ' LYS . . . -78.66 -41.49 31.15 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.78 -26.36 65.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.1 mt -80.32 -48.27 20.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.942 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.427 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 2.7 pptp? -69.69 -32.67 71.42 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.764 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 51.9 tttp -68.24 -44.98 74.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.939 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.73 -43.4 98.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.1 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.16 -16.71 52.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.615 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -87.0 -43.02 12.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.795 0.331 . . . . 0.0 111.115 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -90.26 21.77 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.649 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -138.0 -42.87 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.659 0.266 . . . . 0.0 111.226 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -111.29 10.6 21.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.664 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 62.5 142.72 0.06 OUTLIER Pre-proline 0 CA--C 1.529 0.165 0 CA-C-O 120.638 0.256 . . . . 0.0 110.898 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -50.0 173.91 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.339 2.026 . . . . 0.0 112.358 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -125.15 112.28 16.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.015 0.526 . . . . 0.0 110.611 -0.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.526 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 7.1 m95 -102.32 -167.29 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.802 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -176.14 90.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.8 t -89.19 144.32 26.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.491 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.498 ' CG2' ' CZ ' ' A' ' 62' ' ' PHE . 9.2 mm -115.15 150.94 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.66 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.492 ' HA ' HG12 ' A' ' 83' ' ' ILE . 47.7 t -137.42 91.66 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.267 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.77 -83.55 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.218 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.0 mtm-85 -140.97 -75.86 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.38 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.529 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -161.07 23.1 0.13 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.895 -179.645 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.7 p90 -71.91 2.47 5.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -177.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.81 -58.6 13.72 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m 44.69 54.01 6.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.477 ' CG ' ' O ' ' A' ' 65' ' ' TYR . 37.8 t80 -165.77 31.6 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.745 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.456 ' HA ' ' CD2' ' A' ' 86' ' ' PHE . 59.7 t -84.6 -72.77 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.396 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.6 m -69.64 -26.07 64.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.996 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -46.62 -25.29 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.847 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 17.1 pt-20 -103.88 -63.6 1.18 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.709 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.478 ' C ' ' HD2' ' A' ' 71' ' ' LYS . 2.6 t -150.94 -116.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.478 ' HD2' ' C ' ' A' ' 70' ' ' THR . 7.5 mptt -154.29 30.61 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.685 0.278 . . . . 0.0 110.954 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -105.94 68.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.871 0.367 . . . . 0.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.46 ' CE1' ' CE2' ' A' ' 75' ' ' TYR . 5.6 p90 -117.74 175.5 5.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.176 0.512 . . . . 0.0 111.434 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' A' ' 18' ' ' GLN . 9.4 tt -160.4 110.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.359 178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.46 ' CE2' ' CE1' ' A' ' 73' ' ' PHE . 66.4 m-85 -91.4 140.04 30.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.921 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.625 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 24.8 p90 -161.14 121.0 2.65 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 110.079 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.463 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 31.6 t80 -92.6 139.22 30.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.949 -177.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.43 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -111.5 162.98 14.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.89 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -51.79 100.14 0.05 OUTLIER Glycine 0 CA--C 1.521 0.418 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.423 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.46 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 71.85 25.09 3.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.149 0.499 . . . . 0.0 110.685 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.463 ' O ' ' CD1' ' A' ' 77' ' ' TYR . 95.9 t -155.54 158.82 3.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.924 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -132.42 143.12 49.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.704 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.625 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 54.0 mt -140.16 137.78 37.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.724 0.297 . . . . 0.0 110.68 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.422 ' CD2' ' N ' ' A' ' 84' ' ' LEU . 0.3 OUTLIER -138.12 115.67 11.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.449 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 56.1 tp -102.18 130.73 48.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.629 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.456 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.3 p90 -151.67 157.71 42.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.526 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -146.62 162.67 37.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.942 -179.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' A' ' 69' ' ' GLU . 93.4 p -94.07 167.8 11.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.054 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.528 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.157 0 CA-C-O 120.639 0.257 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.8 t -148.79 107.98 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.41 ' CD1' ' OE1' ' A' ' 18' ' ' GLN . 68.4 mt -86.05 115.85 28.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.899 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -84.84 -31.08 24.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.621 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -171.9 112.08 0.3 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.06 105.94 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.036 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.426 ' OD1' ' CD1' ' A' ' 73' ' ' PHE . 12.6 p-10 -77.63 -4.41 45.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.245 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.476 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.3 tpp -75.02 165.77 24.73 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' CG ' ' A' ' 15' ' ' GLU . 79.8 p -50.54 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.631 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 47.4 mt-10 -162.99 -36.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.55 0.691 . . . . 0.0 110.194 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.53 -27.64 57.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.476 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.9 mpt? -77.67 -25.35 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.441 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.631 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 41.2 mm-40 -65.51 -50.12 66.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -77.48 -32.47 54.36 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.688 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -73.64 -50.4 21.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.858 0.361 . . . . 0.0 110.602 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -59.82 -47.77 84.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.315 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.431 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 98.8 t -58.76 -51.61 69.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.066 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.21 -28.39 65.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.556 0.217 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 24.7 t -71.48 -32.34 68.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.01 -25.55 37.12 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.115 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.1 m -79.55 -45.11 19.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.119 0.485 . . . . 0.0 109.811 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.503 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.5 mt-30 -73.12 -26.34 61.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.324 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.67 -39.96 50.49 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.075 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -73.1 -32.33 64.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 12.4 pt-20 -80.58 -45.28 17.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.104 0.478 . . . . 0.0 109.758 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -71.52 -20.82 61.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -142.49 133.14 25.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.903 0.382 . . . . 0.0 111.088 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -102.72 29.94 5.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.492 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.444 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 9.8 mt -115.11 168.79 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -113.24 18.87 17.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.524 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.415 ' HG2' HG21 ' A' ' 34' ' ' ILE . 65.0 pttt -125.97 -44.39 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.732 0.301 . . . . 0.0 110.223 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -68.2 -17.09 64.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.444 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 40.1 mm -69.63 -51.76 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.399 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.78 -22.16 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.108 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.66 -38.89 25.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.419 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -70.54 -26.31 63.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.19 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.6 mt -84.01 -43.85 17.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.26 -35.6 79.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.64 178.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 26.6 tptp -68.86 -59.89 2.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.387 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.415 ' HG3' ' CE1' ' A' ' 41' ' ' TYR . 5.4 mm-40 -49.57 -51.72 35.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.89 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.508 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 14.6 m-85 -67.75 -31.23 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.395 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -73.58 -26.27 60.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 0.0 110.794 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -90.05 -24.77 21.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.98 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -95.76 -57.91 2.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.202 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.417 ' CZ ' ' HE1' ' A' ' 17' ' ' MET . 47.8 m-85 -94.69 17.05 14.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 58.98 161.17 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.33 170.2 15.29 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.602 2.201 . . . . 0.0 111.922 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.0 m -124.5 104.73 8.89 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.282 0.633 . . . . 0.0 110.572 -0.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.476 ' HB3' HD13 ' A' ' 85' ' ' LEU . 7.3 m95 -99.9 -171.11 1.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.59 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 77.9 t60 -179.98 85.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.955 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.8 t -66.65 153.28 43.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.861 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.49 ' O ' ' CG2' ' A' ' 83' ' ' ILE . 19.6 mm -118.16 138.73 47.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.282 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.564 ' HA ' HG12 ' A' ' 83' ' ' ILE . 14.6 p -119.48 62.39 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.46 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.68 -92.73 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.597 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -144.94 -65.25 0.34 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.0 111.349 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.508 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.87 19.3 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.843 -179.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.442 ' CE1' HG22 ' A' ' 57' ' ' ILE . 5.5 p90 -67.49 5.16 0.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.14 57.82 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.878 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.9 m -69.08 55.47 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.027 0.441 . . . . 0.0 111.662 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 4.7 m-85 -99.22 35.11 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.55 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.452 ' O ' ' HB ' ' A' ' 70' ' ' THR . 44.2 t -98.48 -1.34 10.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.791 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.9 m -115.55 -27.7 7.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 0.0 111.043 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.555 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 36.1 m80 -50.12 -26.43 4.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.242 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.555 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 22.6 pt-20 156.66 45.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 120.889 0.376 . . . . 0.0 110.975 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 20.0 m -94.04 -84.05 0.32 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.481 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.3 OUTLIER 74.84 -12.41 0.94 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.536 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.422 ' CD2' ' HE1' ' A' ' 13' ' ' MET . 9.0 t-160 -139.02 82.87 1.92 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.523 ' HD1' ' N ' ' A' ' 74' ' ' ILE . 7.7 p90 -110.51 -172.3 2.0 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.085 0.469 . . . . 0.0 111.753 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.523 ' N ' ' HD1' ' A' ' 73' ' ' PHE . 5.5 tt -160.93 113.16 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.749 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.457 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 8.1 m-30 -100.94 153.72 19.28 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.484 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.496 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 20.6 p90 -170.27 137.49 1.5 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.721 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -93.67 134.24 36.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.158 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 81.4 mt -131.72 125.44 32.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.84 -110.94 1.42 Allowed Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.086 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.554 ' HA ' ' NE2' ' A' ' 80' ' ' GLN . 5.0 mm100 -128.61 49.65 2.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.346 0.593 . . . . 0.0 110.603 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' A' ' 80' ' ' GLN . 91.7 t -160.2 138.61 2.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.638 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -83.91 134.06 34.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.272 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.564 HG12 ' HA ' ' A' ' 58' ' ' VAL . 63.3 mt -135.69 133.41 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.478 HD23 HG12 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -148.87 143.89 26.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.743 -0.783 . . . . 0.0 112.474 -179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.508 ' CD2' ' CD2' ' A' ' 46' ' ' PHE . 61.1 tp -116.81 155.99 28.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.271 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.438 ' CE1' ' O ' ' A' ' 55' ' ' HIS . 10.9 p90 -164.3 158.68 19.04 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 0.0 111.977 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.431 ' HB2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -108.25 76.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.737 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 81.2 p -74.91 73.97 2.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.407 -1.219 . . . . 0.0 112.56 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.434 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.413 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.504 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.504 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.676 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.408 ' O ' ' CB ' ' A' ' 21' ' ' ALA . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.676 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 24' ' ' CYS . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' ASP . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.403 ' CE ' HG13 ' A' ' 58' ' ' VAL . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.42 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CZ3' ' HB2' ' A' ' 87' ' ' LYS . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.491 ' O ' HG21 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.403 HG13 ' CE ' ' A' ' 29' ' ' MET . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.619 ' O ' ' HB3' ' A' ' 61' ' ' ASN . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.619 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.51 ' N ' HD21 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.421 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.417 HG22 ' CE1' ' A' ' 86' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.526 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.526 ' H ' ' CG2' ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.477 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.47 ' CE2' ' CD1' ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.483 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.434 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.491 HG21 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.476 HD22 ' HB ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.621 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' HG23 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.65 0.262 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.9 155.17 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.992 0.425 . . . . 0.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.49 ' CD1' ' HB3' ' A' ' 18' ' ' GLN . 77.6 mt -130.11 123.19 55.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.668 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -87.14 -31.93 20.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.442 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -178.99 110.92 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.607 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.1 144.95 20.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.191 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.486 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.3 t70 -143.47 18.22 1.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.61 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.478 ' CG ' ' HG3' ' A' ' 17' ' ' MET . 50.3 tpp -69.5 65.65 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.69 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 47.1 t 56.97 12.7 1.27 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.545 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 47.6 mt-10 69.35 -49.77 0.61 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -46.31 -36.16 6.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.646 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.478 ' HG3' ' CG ' ' A' ' 13' ' ' MET . 21.8 mmt -75.84 -24.41 55.81 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.769 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.545 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 64.9 mt-30 -67.02 -41.7 86.16 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -82.53 -34.54 27.86 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.021 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' OD1' ' A' ' 23' ' ' ASP . 7.8 t0 -74.81 -37.76 62.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.154 0.502 . . . . 0.0 110.527 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -71.01 -45.66 63.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.708 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.474 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 73.9 t -59.43 -55.11 25.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.266 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 20' ' ' ASP . 57.7 p30 -67.25 -25.23 65.98 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.057 -0.257 . . . . 0.0 110.987 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 54.1 t -72.46 -36.53 68.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -75.12 -26.33 59.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.645 178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -76.65 -53.97 7.3 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.745 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.419 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -63.4 -24.57 67.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.451 178.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.02 58.42 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.64 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.6 ptp -75.75 -24.6 56.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.131 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -79.35 -51.01 9.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.0 110.075 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -72.16 -27.12 62.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.575 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -135.3 146.79 48.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.753 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -134.44 42.57 2.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.027 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.5 mt -101.43 -13.31 8.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.555 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.9 mt-10 76.85 -54.51 0.57 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.212 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -71.98 -56.03 6.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.485 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -55.07 -25.49 31.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.61 -49.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.38 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.15 -22.58 66.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.161 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.74 -40.42 22.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.403 ' O ' ' CD1' ' A' ' 41' ' ' TYR . 5.4 t80 -68.36 -28.35 67.05 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.33 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.5 mt -77.36 -49.92 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.985 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.6 ptmt -65.34 -36.26 83.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.7 tptm -55.24 -55.55 30.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.65 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.06 -54.97 38.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.839 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.411 ' CE1' ' OD1' ' A' ' 20' ' ' ASP . 7.8 m-85 -63.54 -20.05 65.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.263 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -74.44 -56.31 4.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.656 0.265 . . . . 0.0 111.255 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -87.0 7.81 26.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.757 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -114.37 -29.89 6.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 111.025 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CZ ' ' CE ' ' A' ' 17' ' ' MET . 48.6 m-85 -130.37 6.55 4.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.42 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.53 150.63 0.1 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-O 120.636 0.255 . . . . 0.0 111.049 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -56.92 172.55 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.526 2.151 . . . . 0.0 112.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -121.97 126.4 48.49 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.105 0.562 . . . . 0.0 110.709 -0.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.458 ' N ' ' CD1' ' A' ' 54' ' ' TRP . 3.6 m95 -122.29 172.17 8.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.758 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -149.74 81.62 1.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.327 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 31.2 p -72.9 138.38 46.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.476 HG21 ' CE1' ' A' ' 62' ' ' PHE . 29.2 mm -109.04 147.15 13.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.379 179.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.47 ' N ' HG22 ' A' ' 57' ' ' ILE . 52.9 t -129.44 74.27 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.41 ' HA2' ' CG1' ' A' ' 81' ' ' VAL . . . 178.94 -100.16 0.14 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.383 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -126.68 -77.1 0.58 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 120.881 0.372 . . . . 0.0 110.882 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.489 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.53 19.44 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.091 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.476 ' CE1' HG21 ' A' ' 57' ' ' ILE . 8.1 p90 -58.62 -15.53 12.0 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.62 54.26 0.76 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.46 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.446 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 41.0 t -60.88 -95.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 36.9 p90 41.71 37.87 0.83 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.476 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.452 ' CG2' ' CE1' ' A' ' 86' ' ' PHE . 47.6 t -60.07 -39.04 79.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.1 m -68.94 -29.13 67.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -49.79 -26.09 3.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 110.27 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.492 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 8.8 mp0 -82.01 -77.25 0.23 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.416 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.516 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 1.2 t -172.42 -86.63 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.272 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.516 ' H ' ' CG2' ' A' ' 70' ' ' THR . 1.5 tptm -166.95 29.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.214 0.53 . . . . 0.0 109.841 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.406 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 93.4 m-70 -129.29 81.27 2.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.618 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.491 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 5.9 p90 -112.7 179.06 4.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.929 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.466 HG23 ' O ' ' A' ' 74' ' ' ILE . 8.0 tt -162.29 111.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.457 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.434 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 7.0 m-30 -100.61 151.03 22.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.495 ' CZ ' HG21 ' A' ' 83' ' ' ILE . 1.7 p90 -168.18 116.4 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.967 0.413 . . . . 0.0 110.802 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -84.7 141.14 30.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.89 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.403 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 80.0 mt -139.05 135.8 34.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.18 -93.15 0.01 OUTLIER Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.761 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.409 ' OE1' ' CG2' ' A' ' 81' ' ' VAL . 0.0 OUTLIER -139.93 20.9 2.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.688 0.28 . . . . 0.0 111.608 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.41 ' CG1' ' HA2' ' A' ' 59' ' ' GLY . 92.3 t -140.26 129.95 28.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.87 0.367 . . . . 0.0 110.862 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.08 128.53 35.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.818 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.495 HG21 ' CZ ' ' A' ' 76' ' ' PHE . 59.7 mt -104.11 135.87 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.844 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.564 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 10.2 mp -122.42 107.45 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.609 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 74' ' ' ILE . 65.4 tp -110.01 120.35 42.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.872 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.564 ' CE1' ' HB3' ' A' ' 84' ' ' LEU . 1.5 m-85 -111.1 165.14 12.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.868 0.366 . . . . 0.0 111.055 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.455 ' HG2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -136.44 117.72 14.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.659 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.492 ' CA ' ' HB3' ' A' ' 69' ' ' GLU . 46.1 t -98.41 151.81 20.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.913 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.404 ' N ' HG22 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.537 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.845 0.355 . . . . 0.0 111.023 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.497 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 55.4 t -143.83 138.83 25.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.096 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.483 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 2.1 mp -103.97 136.44 37.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.206 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 61.7 mttp -94.28 29.0 2.32 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.577 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.499 ' HB3' ' O ' ' A' ' 9' ' ' LYS . 45.1 t30 87.68 106.68 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.328 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.439 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -126.88 179.05 5.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.05 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -168.6 19.22 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.521 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 44.8 ttp -80.35 62.88 4.63 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.206 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 45.6 m 72.55 1.57 4.03 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 14' ' ' SER . 46.7 mt-10 70.5 -51.18 0.66 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.783 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -48.26 -29.25 3.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.945 0.402 . . . . 0.0 110.326 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.443 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.0 OUTLIER -72.72 -29.86 63.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.464 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.48 ' N ' HD11 ' A' ' 74' ' ' ILE . 65.6 mt-30 -65.29 -38.33 89.89 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -73.63 -44.43 57.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.39 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.71 -54.33 9.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.258 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.35 -52.1 64.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.468 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 78.1 t -57.6 -50.56 76.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.036 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.3 m-20 -69.79 -24.75 63.54 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.787 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -71.75 -38.05 70.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.62 -23.02 53.38 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.779 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.3 m -78.92 -50.88 10.47 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.515 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 23.9 pt20 -69.74 -23.92 63.46 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.373 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.88 -43.49 35.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.062 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.739 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.3 pt-20 -84.25 -43.95 14.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.049 0.452 . . . . 0.0 109.932 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -74.2 -21.02 59.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.41 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 2.3 m-85 -131.28 -172.24 2.79 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.701 0.286 . . . . 0.0 110.808 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -173.97 35.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.807 0.337 . . . . 0.0 111.122 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.2 mt -99.41 -18.07 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 67.45 11.86 8.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.305 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -129.07 -54.44 1.2 Allowed 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -58.7 -23.03 58.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.406 HD11 HG23 ' A' ' 38' ' ' ILE . 44.3 mm -61.37 -58.55 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.359 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.55 -21.21 65.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.937 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -81.81 -41.57 20.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.985 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -70.15 -22.82 62.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.809 0.338 . . . . 0.0 110.582 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.423 HG23 HD11 ' A' ' 42' ' ' ILE . 96.9 mt -82.31 -48.45 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 23.5 pttm -70.47 -33.75 71.62 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.842 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 59.1 mtpt -72.49 -38.42 68.16 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -61.71 -40.81 96.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 110.431 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.45 ' CE2' ' CD2' ' A' ' 85' ' ' LEU . 4.5 m-85 -81.51 -36.73 28.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.396 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -75.03 -26.62 59.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.664 0.269 . . . . 0.0 111.369 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -90.24 29.52 1.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.813 0.339 . . . . 0.0 111.212 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -155.0 -44.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.678 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -106.94 -4.89 18.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.461 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.418 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 74.0 m-80 63.53 162.33 0.12 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-O 120.647 0.261 . . . . 0.0 111.122 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 79.6 Cg_exo -46.32 173.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.826 2.351 . . . . 0.0 112.38 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 66.7 p -119.24 115.08 23.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.232 0.613 . . . . 0.0 110.629 -0.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.64 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 1.1 m95 -114.62 -174.13 2.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.136 0.493 . . . . 0.0 110.932 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 58.5 m-70 -163.45 61.8 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.202 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.5 t -53.52 137.88 35.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.402 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.548 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 28.8 mm -115.59 149.84 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.343 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.458 ' N ' HG23 ' A' ' 57' ' ' ILE . 47.7 t -141.34 53.83 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.132 0.491 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -155.06 -67.3 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.72 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.505 ' N ' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -177.23 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.681 0.276 . . . . 0.0 111.351 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -172.5 18.54 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.548 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 39.4 p90 -59.89 -33.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.431 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.76 -58.21 5.45 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.337 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.422 ' O ' ' CD1' ' A' ' 65' ' ' TYR . 81.2 p 51.41 75.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD1' ' O ' ' A' ' 64' ' ' SER . 23.1 m-85 -143.1 29.72 1.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.214 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.442 ' O ' ' N ' ' A' ' 70' ' ' THR . 47.7 t -58.73 -62.08 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.701 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.403 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 86.6 m -55.52 -31.7 62.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.83 0.347 . . . . 0.0 110.949 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.458 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 18.7 t-160 -77.13 -5.52 49.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.066 178.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.467 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 89.3 mt-10 -160.47 50.58 0.28 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 66' ' ' VAL . 98.9 m -86.48 -9.05 57.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -45.28 -24.66 0.3 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.718 0.294 . . . . 0.0 111.744 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 71' ' ' LYS . 4.3 m170 -171.91 99.92 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.109 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' A' ' 13' ' ' MET . 2.1 p90 -113.97 166.55 11.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.502 . . . . 0.0 111.761 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.494 HG22 ' O ' ' A' ' 85' ' ' LEU . 8.2 tt -158.79 123.71 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.001 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.415 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 13.8 m-30 -111.18 139.31 46.67 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.486 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 16.8 p90 -170.47 132.37 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.025 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.602 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 2.5 p90 -126.43 154.31 43.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.737 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 81.5 mt -115.58 103.13 10.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.519 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.26 -86.67 0.4 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.485 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.479 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -124.63 -11.79 7.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.7 t -95.59 120.15 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.718 0.294 . . . . 0.0 110.778 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.602 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -98.48 129.0 45.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 111.758 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.486 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 69.3 mt -109.34 131.39 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.014 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.415 ' HG ' ' CD1' ' A' ' 75' ' ' TYR . 6.4 mp -127.88 107.79 10.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.646 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.494 ' O ' HG22 ' A' ' 74' ' ' ILE . 67.0 tp -106.91 133.81 51.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.405 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.505 ' HB3' ' HA ' ' A' ' 73' ' ' PHE . 10.6 p90 -169.72 157.09 6.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.087 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.64 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -144.99 157.67 44.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.281 0.563 . . . . 0.0 111.795 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.467 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 41.9 t -87.61 179.49 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.2 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.332 -1.26 . . . . 0.0 112.451 179.692 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.715 0.293 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.477 ' HB ' ' CZ ' ' A' ' 77' ' ' TYR . 43.7 t -131.72 149.18 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.134 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.473 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 2.8 mp -108.0 138.05 36.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.106 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 27.5 mtpp -96.92 29.4 3.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.11 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.48 ' HB3' ' O ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER 88.97 85.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.576 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.454 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -98.81 165.75 11.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.184 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.1 t70 -148.93 21.57 0.99 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.552 ' O ' ' HG2' ' A' ' 13' ' ' MET . 47.3 ttm -94.54 42.27 1.09 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 16' ' ' ASP . 50.0 m 68.19 111.94 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.853 0.359 . . . . 0.0 110.321 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.419 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 8.6 mp0 -33.69 -34.62 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.194 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 14' ' ' SER . 7.5 t70 -55.82 -45.22 78.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.863 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.461 ' HG3' ' HG2' ' A' ' 13' ' ' MET . 23.4 mmt -69.96 -22.14 63.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.757 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.472 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 0.7 OUTLIER -68.78 -39.57 80.14 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.62 -38.61 54.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.823 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -72.8 -54.41 8.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.433 . . . . 0.0 110.535 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.23 -49.86 70.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.284 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 77.8 t -57.86 -54.66 28.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.199 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.549 ' O ' HG23 ' A' ' 26' ' ' THR . 63.2 m-20 -66.78 -26.13 66.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.805 0.336 . . . . 0.0 110.746 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -73.05 -29.09 62.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.67 -31.83 52.79 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.346 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.549 HG23 ' O ' ' A' ' 23' ' ' ASP . 3.9 t -78.48 -48.73 14.75 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.155 -0.684 . . . . 0.0 109.155 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' N ' ' CG2' ' A' ' 26' ' ' THR . 11.6 mm100 -64.42 -25.6 68.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.125 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.96 -44.63 47.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.977 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -24.07 55.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.22 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 26' ' ' THR . 96.5 mt-10 -77.51 -55.84 5.04 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.984 0.421 . . . . 0.0 110.021 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.81 -25.17 67.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.762 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -141.18 135.05 30.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -102.28 26.1 8.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.319 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.417 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 5.6 mm -98.55 177.14 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -115.22 0.22 13.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.662 0.268 . . . . 0.0 110.935 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.464 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 8.0 mtpm? -111.27 -47.69 3.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.272 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -59.71 -26.21 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 39.8 mm -63.85 -58.97 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.341 179.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -19.84 64.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.0 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -78.9 -43.12 25.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.98 -28.26 66.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.003 0.43 . . . . 0.0 110.015 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.426 HD12 HG21 ' A' ' 42' ' ' ILE . 74.4 mt -82.59 -46.59 19.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.485 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -67.88 -30.77 70.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.169 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 45.3 mmtm -79.03 -40.26 31.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.78 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.5 -42.38 87.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.031 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -82.0 -45.43 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.763 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -25.67 65.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.453 ' NZ ' ' HB2' ' A' ' 48' ' ' LYS . 4.7 ttmp? -71.06 -21.27 62.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.615 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -125.13 -4.44 7.42 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.422 ' CZ ' ' HE3' ' A' ' 17' ' ' MET . 2.8 m-85 -130.19 4.98 4.84 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.89 156.78 0.1 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 111.146 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.425 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.7 Cg_endo -60.49 174.66 1.46 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.545 2.163 . . . . 0.0 112.089 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.425 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 9.0 t -122.26 125.21 45.54 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.132 0.573 . . . . 0.0 110.884 0.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.523 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.0 m95 -117.27 -171.61 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.463 ' CD2' HD13 ' A' ' 57' ' ' ILE . 73.4 t60 -174.31 72.64 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.998 0.427 . . . . 0.0 110.878 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.9 t -59.43 128.85 39.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.836 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.506 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 33.3 mm -98.5 147.22 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.439 ' N ' HG23 ' A' ' 57' ' ' ILE . 49.1 t -127.98 65.16 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.821 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.11 -97.15 0.11 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -123.6 -83.75 0.65 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.656 0.265 . . . . 0.0 110.922 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.456 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -152.34 10.96 0.52 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.818 -179.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.506 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 23.2 p90 -49.24 -24.1 1.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -177.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.85 44.64 1.33 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.456 -0.878 . . . . 0.0 113.068 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.6 m -93.59 62.13 3.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -109.75 29.79 7.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.164 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.445 ' CB ' ' HB2' ' A' ' 86' ' ' PHE . 47.6 t -118.37 -22.59 4.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.549 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.9 m -48.45 -27.69 2.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -45.7 -28.25 0.98 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.447 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.5 mm-40 -108.55 -67.51 0.97 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.219 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.447 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 11.4 m 80.47 0.6 1.92 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.901 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.487 ' HG3' ' CE1' ' A' ' 72' ' ' HIS . 21.9 tptm -47.1 -28.52 1.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.196 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.487 ' CE1' ' HG3' ' A' ' 71' ' ' LYS . 67.0 m80 -157.05 93.94 1.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.395 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.568 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -120.98 152.28 38.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.235 -179.383 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.525 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 7.9 tt -152.42 120.5 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.217 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -107.68 139.26 42.5 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.921 0.391 . . . . 0.0 111.376 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.488 ' CZ ' HG22 ' A' ' 83' ' ' ILE . 1.5 p90 -170.28 122.22 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.489 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.562 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 4.8 p90 -104.99 144.7 31.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.062 0.458 . . . . 0.0 111.526 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -111.98 110.98 21.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.422 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -76.58 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.422 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -149.02 25.7 0.91 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 0.0 111.035 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.26 100.87 3.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.562 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -69.76 127.27 32.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.607 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.488 HG22 ' CZ ' ' A' ' 76' ' ' PHE . 62.5 mt -104.04 138.53 28.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.553 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 11.0 mp -128.09 103.66 7.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.019 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.525 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 59.1 tp -108.31 113.31 26.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.49 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 9.0 m-85 -127.14 -179.19 4.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 111.565 -178.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.523 ' HB2' ' CE3' ' A' ' 54' ' ' TRP . 1.5 tmtp? -151.87 98.47 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.069 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 t -73.17 81.05 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.829 0.347 . . . . 0.0 110.838 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.463 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.764 0.316 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 26.6 t -153.76 163.91 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.243 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -114.69 115.31 49.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.343 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -70.07 -41.26 74.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.272 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.66 74.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 0.0 110.679 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.472 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -79.18 142.63 36.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.482 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 8.8 t70 -146.78 23.55 1.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.68 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.492 ' HE1' ' O ' ' A' ' 72' ' ' HIS . 27.4 ttm -107.9 47.58 0.89 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.076 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.465 ' HB3' ' O ' ' A' ' 13' ' ' MET . 33.2 t 74.37 114.82 0.06 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.617 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.459 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 16.6 pt-20 -32.56 -35.67 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.666 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 14' ' ' SER . 65.9 t0 -54.55 -37.57 65.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.858 0.361 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.431 ' O ' ' CB ' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -74.71 -19.82 60.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.467 ' OE1' ' N ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -70.76 -45.06 65.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -78.75 -32.95 46.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.582 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.436 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.9 t70 -72.09 -46.62 56.05 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.431 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -61.08 -41.61 96.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.636 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.465 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 76.6 t -57.69 -58.46 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-O 120.716 0.293 . . . . 0.0 110.587 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 55.9 m-20 -66.13 -30.39 70.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.187 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.416 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 42.1 t -68.67 -33.9 74.78 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.92 -25.38 37.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.678 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.6 m -74.86 -49.86 19.02 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.782 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 23' ' ' ASP . 9.1 mp0 -73.53 -24.38 60.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.84 -45.73 70.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.905 0.383 . . . . 0.0 110.255 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.0 mmt -79.53 -19.7 48.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.784 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -79.3 -46.45 17.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.542 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -81.07 -18.28 47.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.316 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -149.84 167.09 27.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.811 0.339 . . . . 0.0 111.35 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -156.54 45.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.993 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.2 mt -99.65 -7.06 9.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.391 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.9 mt-10 76.44 -56.07 0.57 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.954 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.474 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 7.9 mtpm? -76.76 -53.66 7.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.578 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -55.6 -26.81 45.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.223 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.27 -52.32 62.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.279 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.11 -26.59 62.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.047 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.577 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -77.45 -42.91 34.24 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.96 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.429 ' CE1' ' OE2' ' A' ' 45' ' ' GLU . 5.1 t80 -68.88 -31.14 69.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.069 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.416 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 97.2 mt -76.62 -50.65 21.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.744 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.577 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 17.9 ptpt -63.63 -35.19 79.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.506 ' C ' ' HD3' ' A' ' 44' ' ' LYS . 0.9 OUTLIER -56.41 -52.57 64.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.623 179.271 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.429 ' OE2' ' CE1' ' A' ' 41' ' ' TYR . 94.3 mt-10 -58.15 -48.68 79.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.675 0.274 . . . . 0.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.436 ' CZ ' ' OD2' ' A' ' 20' ' ' ASP . 8.3 m-85 -64.97 -21.13 66.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.617 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 41.8 m-20 -80.33 -34.36 36.75 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.652 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 7.7 mmpt? -90.13 13.95 13.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.541 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.446 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 6.7 ttpm? -119.43 -6.75 10.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.484 0.183 . . . . 0.0 111.329 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' HE2' ' A' ' 49' ' ' LYS . 51.2 m-85 -148.61 -79.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 111.07 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -177.98 135.77 0.35 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.716 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.31 169.27 22.02 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.425 2.083 . . . . 0.0 112.445 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.9 m -114.32 127.85 56.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.982 0.513 . . . . 0.0 110.844 0.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.455 ' CD1' ' OD1' ' A' ' 47' ' ' ASP . 7.9 m95 -89.02 176.06 7.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.053 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.435 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 73.8 t60 -155.4 103.97 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.952 0.406 . . . . 0.0 110.841 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.1 t -93.83 147.37 23.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.066 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.457 ' CG2' ' CZ ' ' A' ' 62' ' ' PHE . 6.9 mm -117.46 162.41 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.66 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 59.1 t -147.19 87.51 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.052 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.66 -87.5 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.465 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 77.9 mtt-85 -157.99 66.54 0.47 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.946 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.465 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER 49.46 15.67 0.14 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.252 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.457 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 6.3 p90 -59.68 -19.03 46.9 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.521 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -54.4 -51.26 52.67 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.903 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.1 m 49.34 70.18 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.877 0.37 . . . . 0.0 110.583 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.488 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 1.6 t80 -149.65 50.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.149 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.453 HG13 ' HB ' ' A' ' 70' ' ' THR . 39.4 t -119.67 -0.88 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.069 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -107.21 -29.05 9.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.715 0.293 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 93.2 m-70 -49.09 -27.47 3.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.816 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 14.4 pt-20 153.52 49.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.59 0.556 . . . . 0.0 110.9 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.504 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 44.8 m -103.1 -86.79 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.317 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.4 OUTLIER 75.35 -13.86 0.82 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.65 -179.501 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.492 ' O ' ' HE1' ' A' ' 13' ' ' MET . 53.3 m170 -123.29 81.17 1.86 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 5.7 p90 -114.29 170.95 7.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.716 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.472 HG13 ' CB ' ' A' ' 11' ' ' ALA . 7.5 tt -147.18 108.42 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.579 178.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.429 ' CD1' HD11 ' A' ' 84' ' ' LEU . 7.6 m-30 -76.64 149.87 36.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.487 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 83' ' ' ILE . 3.2 t80 -150.53 135.42 17.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.217 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 51.9 t80 -125.89 127.76 46.52 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.757 0.313 . . . . 0.0 111.459 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.427 HD11 ' N ' ' A' ' 78' ' ' LEU . 0.7 OUTLIER -126.57 109.79 12.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.795 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.41 -88.1 0.01 OUTLIER Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.768 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.508 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -129.61 21.42 5.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 111.021 -179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.415 ' O ' ' CD1' ' A' ' 77' ' ' TYR . 53.8 t -128.16 160.76 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.737 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -130.11 115.04 16.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.785 0.326 . . . . 0.0 111.303 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.561 ' HB ' ' HB3' ' A' ' 76' ' ' PHE . 68.5 mt -95.16 125.01 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.429 HD11 ' CD1' ' A' ' 75' ' ' TYR . 52.0 tp -119.87 107.28 12.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.704 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 59.6 tp -106.87 150.44 26.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.941 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.488 ' CE2' ' O ' ' A' ' 65' ' ' TYR . 17.9 p90 -174.62 178.27 1.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.07 0.462 . . . . 0.0 111.508 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.445 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 5.8 tmtm? -132.76 88.87 2.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.336 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.503 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 43.3 t -73.15 69.24 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.581 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.59 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.829 0.347 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.7 t -130.79 135.34 60.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.839 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.502 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.9 mp -104.19 96.93 4.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 27.6 mtpp -60.99 -18.58 58.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 43.7 t30 172.66 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.994 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.5 138.59 14.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.008 0.433 . . . . 0.0 111.664 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.433 ' HB3' ' CE1' ' A' ' 73' ' ' PHE . 38.5 t70 -133.91 12.21 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.768 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.603 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 47.8 ttm -90.7 34.34 0.9 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.22 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.47 ' O ' ' N ' ' A' ' 16' ' ' ASP . 38.6 t 68.4 112.02 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.495 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.4 mt-10 -27.58 -39.08 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.563 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 14' ' ' SER . 1.5 m-20 -51.32 -45.64 62.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.355 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.499 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.6 mpt? -70.76 -23.24 62.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.144 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.495 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 63.0 mt-30 -70.8 -37.87 73.31 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -80.52 -34.57 35.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.68 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -74.93 -50.88 15.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.071 0.462 . . . . 0.0 110.404 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.5 65.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.195 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.452 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 96.5 t -58.65 -47.67 88.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.614 0.245 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 36.5 t70 -66.63 -35.19 79.58 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.628 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.0 t -68.12 -35.2 77.75 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -24.9 49.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.725 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -75.97 -52.89 9.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.875 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 23.5 pt20 -66.95 -26.15 66.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.969 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -56.44 12.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.508 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.409 ' N ' HD13 ' A' ' 38' ' ' ILE . 22.3 ptp -69.28 -18.6 63.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -82.47 -47.82 11.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.245 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -72.86 -27.96 62.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.47 ' CD2' ' OD2' ' A' ' 37' ' ' ASP . 13.1 m-85 -119.24 -170.88 2.01 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.453 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.4 ' ND2' ' O ' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -147.67 27.94 0.97 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.795 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.5 ' HB ' ' OD1' ' A' ' 37' ' ' ASP . 7.1 mt -121.21 170.7 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -114.48 23.79 12.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.779 0.323 . . . . 0.0 110.977 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -124.68 -49.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.578 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.5 ' OD1' ' HB ' ' A' ' 34' ' ' ILE . 9.4 p-10 -64.09 -27.37 69.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.419 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 34.3 mm -61.35 -57.04 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.649 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.62 -28.83 61.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.28 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -76.96 -35.14 57.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -69.38 -30.35 68.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.78 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.555 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.1 mp -84.28 -43.51 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -66.29 -31.95 73.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.939 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 73.2 mmtt -83.45 -39.45 20.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.92 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -54.04 -47.29 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.961 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.462 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 56.1 m-85 -80.05 -44.41 20.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.221 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -67.0 -9.81 42.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.75 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.65 -27.62 34.01 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.97 41.44 0.83 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 9.1 m-85 -132.78 -86.63 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.567 0.223 . . . . 0.0 111.022 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.59 104.78 0.16 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.515 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 31.3 Cg_exo -57.46 160.28 14.32 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.195 1.93 . . . . 0.0 111.996 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.8 m -112.38 142.52 44.82 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.303 0.641 . . . . 0.0 110.621 -0.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.436 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 19.5 m95 -111.08 138.2 47.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.839 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.481 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 52.8 m170 -122.03 98.15 5.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.065 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.0 t -82.04 142.32 32.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.568 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.56 HG13 ' HA2' ' A' ' 63' ' ' GLY . 16.5 mm -117.75 142.92 29.85 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-O 120.842 0.354 . . . . 0.0 111.773 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.482 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 12.3 p -127.71 94.57 2.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.394 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 168.19 -94.43 0.11 Allowed Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.947 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -125.22 -85.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.574 0.225 . . . . 0.0 111.604 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.512 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -146.41 13.81 1.24 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.525 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 21.2 p90 -70.94 52.03 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 111.054 -177.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.56 ' HA2' HG13 ' A' ' 57' ' ' ILE . . . -78.69 -62.0 2.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.419 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' CG ' ' A' ' 65' ' ' TYR . 21.3 m 79.58 116.58 0.06 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.565 ' CG ' ' O ' ' A' ' 64' ' ' SER . 36.1 p90 53.39 64.26 1.92 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.738 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.469 ' HA ' ' CG ' ' A' ' 86' ' ' PHE . 51.8 t -94.4 -24.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.626 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.47 ' CG2' ' HD2' ' A' ' 71' ' ' LYS . 87.2 m -134.82 -32.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.671 0.272 . . . . 0.0 111.555 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.72 -5.93 18.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.535 ' HG2' ' N ' ' A' ' 70' ' ' THR . 13.8 pm0 -91.01 -50.86 5.63 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.555 ' O ' ' CB ' ' A' ' 71' ' ' LYS . 4.5 t -134.4 -44.67 0.76 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' A' ' 70' ' ' THR . 14.2 mmmm 108.69 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.394 1.059 . . . . 0.0 110.017 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 94.3 m-70 -128.54 79.21 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.581 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 13' ' ' MET . 11.0 p90 -118.7 171.64 8.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.429 ' CG2' ' CE ' ' A' ' 13' ' ' MET . 12.4 tt -168.07 111.0 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.094 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.433 ' CZ ' HD11 ' A' ' 84' ' ' LEU . 8.7 m-85 -97.22 154.58 17.3 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.035 0.445 . . . . 0.0 111.576 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 15.0 p90 -170.37 123.67 0.69 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.724 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -88.18 125.77 34.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.592 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.6 mt -123.17 132.87 54.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.218 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.99 -100.0 0.06 OUTLIER Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.792 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.527 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.49 23.84 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.712 0.291 . . . . 0.0 111.014 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 46.9 t -140.64 137.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -90.9 128.66 36.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.077 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.501 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 73.6 mt -118.85 137.44 52.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.516 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.482 ' HG ' ' CG1' ' A' ' 57' ' ' ILE . 0.7 OUTLIER -135.09 113.66 11.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.103 0.478 . . . . 0.0 111.47 179.622 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 46' ' ' PHE . 45.8 tp -98.99 141.05 32.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.67 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.481 ' CZ ' ' HB2' ' A' ' 55' ' ' HIS . 8.0 p90 -156.44 139.86 15.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.448 0.642 . . . . 0.0 111.616 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.569 ' HD3' ' N ' ' A' ' 88' ' ' SER . 1.6 tmtp? -94.32 154.2 17.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.435 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.569 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 8.6 m -127.95 148.44 50.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.845 0.355 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.489 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.875 0.369 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.433 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.498 HG12 ' HB3' ' A' ' 76' ' ' PHE . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.42 ' HB2' ' OE1' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.556 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.556 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.449 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.424 ' CD2' HD23 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.441 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.441 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.412 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.519 HG21 ' CE1' ' A' ' 62' ' ' PHE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.42 ' N ' HG22 ' A' ' 57' ' ' ILE . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.442 ' HA ' ' CB ' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.542 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.519 ' CE1' HG21 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.486 ' CG2' ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.444 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.489 ' CD2' ' HG3' ' A' ' 71' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.475 ' HB ' ' HB2' ' A' ' 13' ' ' MET . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.498 ' HB3' HG12 ' A' ' 8' ' ' ILE . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.489 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.484 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.486 ' CE2' ' CG2' ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.488 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.782 0.325 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -144.46 81.38 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.138 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.536 HG12 ' HB3' ' A' ' 76' ' ' PHE . 61.1 mt -60.75 116.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.969 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -71.95 -44.39 63.66 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 43.9 t30 -153.71 116.98 4.58 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.902 0.382 . . . . 0.0 110.941 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.73 84.0 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.224 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 59.5 t0 -81.1 -5.21 57.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.971 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.446 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.7 tpp -92.99 162.64 13.97 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.58 0.229 . . . . 0.0 110.444 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.418 ' N ' ' HG3' ' A' ' 13' ' ' MET . 62.9 m -40.07 -74.56 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.968 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.474 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 39.6 tt0 177.71 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.527 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -56.85 -33.08 66.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.099 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.446 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.59 -26.77 58.15 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.672 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.474 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 62.8 mt-30 -66.33 -46.07 78.09 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -79.92 -32.55 40.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.94 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.4 t0 -72.67 -50.06 27.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.44 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -58.82 -48.83 79.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.081 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.434 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 90.9 t -55.23 -53.12 38.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.917 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -71.84 -24.5 61.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.834 0.35 . . . . 0.0 110.653 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 39.1 t -72.87 -32.8 65.65 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.07 -27.55 39.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.894 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.7 m -78.2 -45.83 22.03 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.536 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.8 mt-30 -71.98 -24.92 61.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.355 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.0 -41.78 50.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.177 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -74.93 -29.82 61.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.688 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.4 pt-20 -82.38 -43.04 17.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.982 0.42 . . . . 0.0 110.135 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' O ' ' CD1' ' A' ' 32' ' ' TYR . 62.8 tttp -76.31 -21.35 56.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.743 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.4 ' CD1' ' O ' ' A' ' 31' ' ' LYS . 54.7 m-85 -152.51 161.1 43.05 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.979 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -144.5 18.57 1.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.464 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.6 mm -75.77 -13.78 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.379 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 87.2 mt-10 74.94 -54.02 0.67 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.823 0.344 . . . . 0.0 110.772 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -69.75 -57.96 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.51 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.86 -27.22 17.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.305 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.436 ' O ' HG13 ' A' ' 42' ' ' ILE . 49.3 mm -61.31 -54.22 38.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.438 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.14 -27.12 63.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.503 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -80.73 -38.78 28.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.762 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -70.42 -27.6 64.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.358 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 38' ' ' ILE . 86.9 mt -79.55 -47.69 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.553 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -65.29 -38.45 90.26 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.4 tptm -57.02 -57.29 13.2 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.126 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -55.13 -51.24 67.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.225 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.426 ' CE1' ' OD2' ' A' ' 20' ' ' ASP . 39.8 m-85 -62.67 -25.38 68.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.713 0.292 . . . . 0.0 111.115 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -86.45 -25.99 24.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.158 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -89.9 -17.53 27.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.429 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -101.84 -61.14 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.701 0.286 . . . . 0.0 111.353 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -91.71 14.7 14.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.627 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.407 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 75.1 m-20 59.79 157.14 0.1 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.679 0.276 . . . . 0.0 110.94 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 15.2 Cg_endo -57.3 172.63 0.86 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.533 2.155 . . . . 0.0 112.066 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.5 t -122.82 103.41 8.62 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.077 0.551 . . . . 0.0 110.819 0.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.447 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.5 m95 -102.12 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.471 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 78.1 t60 178.17 75.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.238 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.2 t -64.21 148.25 50.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.396 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 83' ' ' ILE . 19.5 mm -114.68 146.18 19.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.604 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.438 ' N ' HG21 ' A' ' 57' ' ' ILE . 48.7 t -133.23 77.22 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.769 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.76 -81.2 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 55.9 mtp85 -142.72 -80.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.748 0.309 . . . . 0.0 111.288 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.473 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.3 14.43 0.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.761 -179.618 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.44 ' CZ ' HG21 ' A' ' 57' ' ' ILE . 5.5 p90 -51.66 -25.67 7.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.341 . . . . 0.0 111.263 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.34 51.96 0.84 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.023 -0.608 . . . . 0.0 111.728 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.0 p -85.78 60.48 6.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.057 0.456 . . . . 0.0 111.178 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 13.8 m-85 -89.47 30.7 0.98 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.685 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.46 ' CG1' ' CD2' ' A' ' 73' ' ' PHE . 66.3 t -46.84 -77.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.9 m -53.08 -30.55 36.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.522 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -56.78 -20.98 25.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.866 0.365 . . . . 0.0 110.258 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.596 ' HG3' ' HB2' ' A' ' 88' ' ' SER . 0.3 OUTLIER -82.39 -73.62 0.39 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.357 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.534 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 1.5 t -175.61 -86.64 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.406 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.534 ' H ' ' CG2' ' A' ' 70' ' ' THR . 13.9 tptt -163.47 26.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.992 0.425 . . . . 0.0 110.373 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -122.88 75.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 9.3 p90 -119.23 -176.25 3.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.192 0.52 . . . . 0.0 111.858 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt 177.68 111.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.421 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 9.3 p90 -123.99 147.93 47.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.289 0.566 . . . . 0.0 111.986 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.536 ' HB3' HG12 ' A' ' 8' ' ' ILE . 2.0 p90 -140.37 170.14 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.846 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -121.21 137.72 54.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.726 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.36 130.88 43.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.116 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.7 -92.09 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.806 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -138.46 33.82 2.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.996 0.426 . . . . 0.0 110.94 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 87.8 t -138.38 150.59 24.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.556 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.92 118.68 36.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.123 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 2.5 mp -105.07 132.97 50.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.452 HD23 ' HB ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -137.61 124.51 21.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.104 0.478 . . . . 0.0 111.487 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 33.2 tp -119.74 137.47 53.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.876 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 2.8 p90 -137.68 152.65 49.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.181 0.515 . . . . 0.0 111.965 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.521 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 6.4 tmtm? -124.94 127.93 47.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.155 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.596 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 29.0 t -96.22 151.3 19.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.623 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.493 ' N ' HG23 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.554 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.776 0.322 . . . . 0.0 110.682 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 44.3 t -134.04 105.34 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.43 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.463 ' CD1' ' CG ' ' A' ' 18' ' ' GLN . 67.6 mt -82.58 113.94 22.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.955 0.407 . . . . 0.0 110.585 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -78.8 -34.3 45.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.955 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -169.88 110.73 0.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.421 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -125.3 137.32 54.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.974 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -140.88 2.03 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.504 ' O ' ' HG2' ' A' ' 13' ' ' MET . 50.2 ttp -94.19 58.87 2.56 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.781 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.9 t 64.18 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.02 0.438 . . . . 0.0 111.283 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.523 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -35.08 -34.51 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.853 179.615 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -50.9 -39.19 53.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.853 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -25.31 64.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.245 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.523 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 2.8 mp0 -68.57 -42.91 77.62 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.068 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -79.05 -32.07 44.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.393 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -77.11 -50.19 13.59 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.896 0.379 . . . . 0.0 110.636 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.78 80.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.874 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.421 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 98.8 t -63.07 -41.05 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.726 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -68.11 -39.68 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 81.1 m -67.71 -32.78 73.66 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.55 46.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.469 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 99.0 m -74.97 -55.24 5.97 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -65.36 -26.63 68.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.212 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.54 -46.55 72.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.613 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.505 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 1.6 tpt -70.06 -27.02 64.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.749 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -83.31 -43.22 16.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.027 0.442 . . . . 0.0 110.125 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -77.86 -22.54 49.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.919 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -133.79 150.05 51.43 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.741 0.305 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -116.37 29.83 7.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.022 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.401 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 4.9 mt -123.55 176.35 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -109.18 14.73 23.7 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.775 0.321 . . . . 0.0 110.786 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.529 ' HA ' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -113.99 -58.9 2.09 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.288 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -53.52 -25.76 18.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.903 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.417 HD12 HG21 ' A' ' 38' ' ' ILE . 40.4 mm -64.0 -59.94 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.465 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 43' ' ' LYS . . . -58.05 -29.91 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.97 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.483 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -71.69 -42.78 67.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.376 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.411 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 5.5 t80 -66.78 -27.8 67.88 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.92 0.391 . . . . 0.0 110.256 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.422 HD11 HG22 ' A' ' 42' ' ' ILE . 75.6 mt -79.06 -50.39 18.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.184 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.483 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.2 pttm -71.23 -27.78 63.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.407 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 55.9 mtpt -71.26 -48.12 52.96 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.648 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -61.39 -37.56 83.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.734 0.302 . . . . 0.0 110.818 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.462 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 4.7 m-85 -83.29 -19.54 36.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.755 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.4 -36.72 16.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.72 0.295 . . . . 0.0 111.395 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 4.0 mptp? -90.27 29.21 1.28 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.363 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -145.86 -44.37 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -104.79 5.79 33.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.45 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 m120 61.61 154.0 0.11 Allowed Pre-proline 0 C--N 1.333 -0.141 0 CA-C-O 120.766 0.317 . . . . 0.0 110.886 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.01 174.77 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.579 2.186 . . . . 0.0 112.173 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -126.84 97.22 4.9 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 123.118 0.567 . . . . 0.0 110.455 -0.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.601 ' HB2' ' O ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -150.9 -179.08 6.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.889 -179.733 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -179.51 -179.63 0.54 Allowed 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 120.935 0.397 . . . . 0.0 111.043 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 31.9 p -116.91 153.33 32.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.357 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 83' ' ' ILE . 19.4 mm -94.38 147.63 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.294 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 11.4 p -122.19 72.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.534 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.52 -78.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.376 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -149.79 -82.09 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.7 0.286 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.468 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 13.02 0.35 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.775 -179.933 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.456 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 4.1 p90 -55.97 -20.29 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -129.14 50.04 0.9 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.732 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.5 m -50.11 -87.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.79 -0.241 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 58.38 61.46 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.004 0.431 . . . . 0.0 110.72 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.461 ' O ' ' HB ' ' A' ' 70' ' ' THR . 43.8 t -116.64 -0.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.838 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -111.37 -28.1 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.777 0.322 . . . . 0.0 111.172 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.585 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 90.4 m-70 -48.37 -27.73 2.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.178 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.585 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 16.6 pt-20 155.22 45.85 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.819 0.447 . . . . 0.0 110.735 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 22.9 m -92.31 -85.96 0.25 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.516 -179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 70' ' ' THR . 31.1 mmmt 76.12 -12.32 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.074 -179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 19.9 m80 -132.89 81.45 1.94 Allowed 'General case' 0 C--O 1.23 0.076 0 CA-C-O 120.962 0.411 . . . . 0.0 110.25 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 17.7 p90 -115.47 -177.08 3.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.651 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.474 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 9.0 tt -168.55 123.24 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.05 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.484 ' CD1' ' CD2' ' A' ' 84' ' ' LEU . 61.4 m-85 -101.76 137.27 40.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 1.3 p90 -159.03 117.54 2.92 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.085 0.469 . . . . 0.0 111.281 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -84.53 136.78 33.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.924 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.0 mt -136.58 123.68 21.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.922 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 54.05 -106.61 0.5 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.541 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -125.46 33.72 5.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 111.352 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 89.0 t -155.46 124.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.64 131.61 34.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.9 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.587 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 63.6 mt -110.02 138.72 36.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.532 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.484 ' CD2' ' CD1' ' A' ' 75' ' ' TYR . 2.8 tm? -135.75 115.59 13.06 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.927 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.572 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 56.0 tp -96.91 136.84 36.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.605 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.601 ' O ' ' HB2' ' A' ' 54' ' ' TRP . 23.6 p90 -142.3 123.64 14.77 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.675 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.528 ' HA ' ' CB ' ' A' ' 54' ' ' TRP . 1.6 tmtp? -84.96 69.3 10.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 47.6 t -76.75 63.66 2.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.539 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.849 0.357 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.517 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 57.9 t -123.68 134.37 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.113 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.511 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 2.0 mp -112.35 101.05 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.177 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.473 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 33.3 mmtp -54.74 -23.14 16.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.87 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 45.1 t30 177.44 119.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.691 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.94 95.62 8.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.852 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.432 ' HB2' ' CE1' ' A' ' 73' ' ' PHE . 65.7 t0 -82.08 -33.31 29.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.153 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.51 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 50.9 tpp -78.01 162.22 26.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.713 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' A' ' 13' ' ' MET . 43.0 t -39.67 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.126 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -178.5 -29.68 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.18 -34.58 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.739 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.51 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 24.0 mmt -74.9 -24.82 58.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.666 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.454 ' HA ' HD13 ' A' ' 74' ' ' ILE . 3.2 mp0 -67.5 -45.14 76.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -81.04 -31.44 34.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.241 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 46' ' ' PHE . 10.2 t0 -77.03 -50.19 13.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.342 . . . . 0.0 110.681 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.404 ' HB2' ' CZ ' ' A' ' 76' ' ' PHE . . . -65.57 -48.09 73.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.318 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.448 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 88.7 t -62.44 -46.16 97.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.427 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 66.3 t0 -72.0 -34.87 69.22 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 121.138 -0.225 . . . . 0.0 110.702 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t -68.9 -33.68 74.17 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.21 -27.08 53.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.523 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 92.7 m -74.96 -53.53 8.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.004 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 24.4 pt20 -68.32 -23.28 64.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.93 -47.82 56.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.915 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -72.21 -27.14 62.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.16 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -79.44 -46.25 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.486 ' HG3' ' CE1' ' A' ' 32' ' ' TYR . 16.9 tppt? -82.37 -24.19 34.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.486 ' CE1' ' HG3' ' A' ' 31' ' ' LYS . 7.6 m-85 -134.77 156.24 49.2 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.844 0.354 . . . . 0.0 110.621 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -143.86 23.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.115 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.469 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.9 mm -78.07 -16.55 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.59 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.469 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 86.4 mt-10 76.71 -54.12 0.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -76.51 -50.32 14.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.357 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -56.14 -29.84 61.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.945 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.01 -53.05 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.351 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -24.16 67.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.947 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.14 -38.09 27.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -70.82 -24.42 62.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.536 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.402 HD12 HG21 ' A' ' 42' ' ' ILE . 79.6 mt -84.91 -46.27 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.412 ' O ' ' HD3' ' A' ' 43' ' ' LYS . 5.3 tmtm? -64.31 -37.71 88.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.686 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 12.2 tppt? -70.71 -56.49 6.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.436 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -49.44 -40.17 35.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.512 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.484 ' CE2' ' CD2' ' A' ' 85' ' ' LEU . 19.2 m-85 -68.37 -51.3 45.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.23 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -68.62 -9.82 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.455 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -59.67 -28.32 67.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.502 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -164.07 32.14 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.45 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 3.4 m-85 -125.85 10.65 7.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.621 0.248 . . . . 0.0 111.196 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 62.99 134.64 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.785 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.413 ' HB2' ' HB ' ' A' ' 53' ' ' THR . 54.8 Cg_endo -70.11 166.89 26.53 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.329 2.019 . . . . 0.0 112.099 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 52' ' ' PRO . 8.8 t -130.75 122.35 27.09 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.234 0.614 . . . . 0.0 110.638 -0.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 54' ' ' TRP . 6.1 m95 -100.12 160.3 14.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.256 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.435 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 89.7 m-70 -131.58 62.38 1.63 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.4 t -55.53 106.95 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.834 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.506 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 25.1 mm -82.29 153.93 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.819 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.425 ' N ' HG23 ' A' ' 57' ' ' ILE . 60.6 t -141.15 68.07 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.93 0.395 . . . . 0.0 110.739 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -174.33 -76.93 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.574 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.9 mtp85 -149.84 -77.91 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.725 0.298 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.483 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -154.96 14.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.608 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.506 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 28.3 p90 -56.98 -16.31 6.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.13 51.58 0.85 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.507 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.497 ' O ' ' CZ ' ' A' ' 86' ' ' PHE . 45.9 t -44.7 -76.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.316 . . . . 0.0 111.631 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 42.59 31.57 0.3 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.489 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.515 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 45.2 t -97.53 -2.84 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.8 m -114.01 -27.41 7.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.822 0.344 . . . . 0.0 111.09 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.577 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 25.5 t-80 -48.28 -27.86 2.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 15.5 pt-20 157.13 44.75 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.422 0.452 . . . . 0.0 111.396 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 73.8 m -86.77 -81.89 0.22 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.333 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 70' ' ' THR . 46.7 mmtm 75.91 -3.73 2.51 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.649 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.439 ' NE2' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -156.48 92.87 1.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.188 0.518 . . . . 0.0 110.716 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.477 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 8.3 p90 -122.62 -170.86 2.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.135 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.495 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 5.5 tt -162.42 110.94 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.567 178.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -99.51 140.12 34.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.457 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.418 ' CZ ' HG23 ' A' ' 83' ' ' ILE . 2.1 p90 -170.17 127.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.101 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.52 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 8.3 p90 -114.47 145.98 41.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.212 0.53 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 81.7 mt -115.58 117.59 30.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.495 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -77.31 0.2 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.413 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -149.56 24.93 0.87 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.1 t -134.14 118.5 28.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.873 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.52 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -92.04 122.78 34.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 112.063 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.472 ' CD1' ' N ' ' A' ' 83' ' ' ILE . 2.3 mp -100.47 133.29 44.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.187 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 84' ' ' LEU . 5.4 mp -120.1 97.99 5.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 111.569 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.495 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 49.8 tp -98.69 134.62 41.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.692 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.497 ' CZ ' ' O ' ' A' ' 64' ' ' SER . 7.0 p90 -171.89 163.96 6.32 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.626 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.439 ' HB3' ' NE2' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -113.77 81.21 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.609 179.109 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 89.3 p -69.02 67.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.843 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.34 -1.256 . . . . 0.0 112.52 179.889 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.875 0.369 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.433 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.498 HG12 ' HB3' ' A' ' 76' ' ' PHE . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.42 ' HB2' ' OE1' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.556 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.556 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.449 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.424 ' CD2' HD23 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.441 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.441 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.412 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.519 HG21 ' CE1' ' A' ' 62' ' ' PHE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.42 ' N ' HG22 ' A' ' 57' ' ' ILE . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.442 ' HA ' ' CB ' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.542 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.519 ' CE1' HG21 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.486 ' CG2' ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.444 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.489 ' CD2' ' HG3' ' A' ' 71' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.475 ' HB ' ' HB2' ' A' ' 13' ' ' MET . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.498 ' HB3' HG12 ' A' ' 8' ' ' ILE . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.489 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.484 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.486 ' CE2' ' CG2' ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.488 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.782 0.325 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.2 t -135.14 90.74 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.474 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -80.88 91.09 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 66.8 mttm -58.79 -20.09 46.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.541 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.45 ' O ' ' HB2' ' A' ' 75' ' ' TYR . 19.9 t-20 173.47 129.66 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.675 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.404 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -146.62 128.74 15.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -131.73 2.91 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.494 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 55.8 ttp -96.47 62.57 2.05 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.934 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 t 64.56 110.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.44 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.497 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.0 mt-10 -40.45 -32.77 0.21 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.246 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -53.94 -35.07 61.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.2 mmt -70.91 -24.42 62.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 3.5 mp0 -71.04 -41.11 71.24 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -77.8 -33.41 52.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.751 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -76.3 -52.52 9.81 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 120.971 0.415 . . . . 0.0 110.668 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.85 -49.94 75.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.446 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 94.4 t -60.37 -51.37 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.46 -29.28 69.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.74 0.305 . . . . 0.0 110.453 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t -71.66 -32.3 67.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.44 -23.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.026 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.0 m -80.56 -44.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -74.45 -28.08 60.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.252 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.13 -50.18 20.54 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.4 tpt -68.46 -25.96 65.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.616 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -80.64 -47.22 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.065 0.459 . . . . 0.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -73.88 -25.03 59.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.678 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -144.28 152.27 40.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.818 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -136.93 46.22 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.477 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 33.7 mt -98.18 -16.69 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.432 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 46.1 mm-40 77.94 -54.84 0.51 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.864 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -74.42 -52.93 10.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -55.75 -29.36 59.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.28 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.07 -50.05 81.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.713 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.6 -20.94 63.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.201 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -82.68 -40.52 20.56 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.832 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -70.76 -26.23 63.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.194 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 85.3 mt -83.41 -46.22 18.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -63.81 -37.69 88.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.267 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 12.8 mmmm -75.23 -31.86 60.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -58.96 -58.89 6.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.72 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.441 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 46.5 m-85 -69.91 -30.71 68.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -64.65 -34.12 77.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.964 0.411 . . . . 0.0 110.96 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.55 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -90.27 30.43 1.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.816 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -152.75 -43.49 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.352 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.57 0.45 15.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.757 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.412 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 5.3 m120 62.71 156.82 0.12 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.711 0.291 . . . . 0.0 111.287 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.418 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 11.2 Cg_endo -54.49 173.52 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.862 2.375 . . . . 0.0 112.212 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.418 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 89.7 m -117.8 128.16 54.59 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.226 0.611 . . . . 0.0 110.463 -0.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.648 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 3.1 m95 -119.3 -168.67 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.053 0.454 . . . . 0.0 111.047 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -168.25 63.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.407 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.1 m -48.4 138.34 10.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.113 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.489 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 20.0 mm -114.48 140.99 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.743 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.408 ' N ' HG21 ' A' ' 57' ' ' ILE . 48.7 t -141.1 76.95 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.95 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.74 -66.93 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.284 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -154.97 -80.9 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.741 0.305 . . . . 0.0 111.057 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.489 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.92 17.88 0.12 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.324 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.1 p90 -52.8 -20.7 3.42 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 65' ' ' TYR . . . -58.52 -60.59 8.66 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.158 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p 49.6 26.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 13.8 m-30 -111.81 41.37 1.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.922 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 49.0 t -75.53 -71.34 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.815 0.34 . . . . 0.0 111.301 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.5 m -76.97 -28.65 55.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.219 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.401 ' ND1' ' O ' ' A' ' 68' ' ' HIS . 26.1 t-80 -54.63 -21.05 9.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.198 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.458 ' HB2' ' HB3' ' A' ' 88' ' ' SER . 10.3 pt-20 -110.01 -55.23 2.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.478 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 71' ' ' LYS . 28.3 m -162.89 -101.71 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.074 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HE3' ' CE1' ' A' ' 72' ' ' HIS . 0.0 OUTLIER 179.95 25.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.789 0.328 . . . . 0.0 111.383 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.449 ' O ' ' HA ' ' A' ' 86' ' ' PHE . 92.2 m-70 -107.83 68.02 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.967 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 36.7 p90 -107.04 -174.99 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.216 0.532 . . . . 0.0 111.425 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.407 HD11 ' HA ' ' A' ' 18' ' ' GLN . 12.2 tt -169.65 109.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.5 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 73' ' ' PHE . 56.1 m-85 -89.83 138.85 31.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.762 0.315 . . . . 0.0 111.186 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.488 ' CZ ' HG21 ' A' ' 83' ' ' ILE . 1.9 p90 -166.39 112.13 0.83 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 0.0 110.824 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -91.88 129.36 37.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.3 mt -119.29 134.94 54.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 0.0 111.211 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.18 -103.92 0.14 Allowed Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.798 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -128.12 33.04 4.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.921 0.391 . . . . 0.0 111.189 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.6 t -146.06 140.64 21.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.581 179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -93.25 131.69 38.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.796 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.488 HG21 ' CZ ' ' A' ' 76' ' ' PHE . 63.0 mt -127.4 132.54 69.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.455 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.468 HD22 ' HB ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -144.78 127.38 16.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.056 0.455 . . . . 0.0 111.579 -179.442 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' A' ' 46' ' ' PHE . 29.8 tp -109.11 141.04 41.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.45 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -157.97 154.73 28.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.003 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.648 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -140.41 154.18 46.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.013 0.435 . . . . 0.0 111.688 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.458 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 92.9 p -81.28 76.86 8.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.079 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.417 ' HA2' ' HE2' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.329 -1.262 . . . . 0.0 112.766 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.826 0.346 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.2 t -144.36 88.68 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.028 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.424 HD13 HG22 ' A' ' 8' ' ' ILE . 79.5 mt -59.41 129.15 21.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -112.02 -23.11 10.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.188 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -165.48 85.6 0.37 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.882 0.372 . . . . 0.0 110.863 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -106.97 95.69 5.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.51 -11.16 59.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.368 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.464 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 43.4 tpp -78.34 158.73 28.72 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.708 0.29 . . . . 0.0 110.735 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -41.63 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.205 -179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.466 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 44.7 tt0 -178.27 -31.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.58 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -55.42 -32.17 62.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.844 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.464 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.1 mpt? -77.24 -24.84 51.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.563 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.469 ' OE1' ' N ' ' A' ' 18' ' ' GLN . 2.0 mp0 -66.67 -45.46 78.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.21 -32.1 29.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.308 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.412 ' OD2' ' CE1' ' A' ' 46' ' ' PHE . 67.7 t0 -75.35 -47.55 27.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 110.656 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.468 ' CB ' ' CE2' ' A' ' 76' ' ' PHE . . . -66.45 -49.14 67.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.139 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.453 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 86.2 t -60.23 -41.61 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.79 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -77.12 -31.68 55.93 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.625 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 37.9 t -72.07 -29.81 64.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.1 -26.89 33.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.977 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.3 m -78.9 -45.78 19.85 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.728 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -72.35 -28.35 62.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -67.53 -56.17 10.59 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.391 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 67.1 mtm -70.11 -20.15 63.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.643 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -81.14 -45.03 17.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -83.78 -26.33 29.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.7 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -137.65 170.03 16.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -154.48 54.79 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 21.4 mt -108.11 -11.11 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.477 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 7.9 mp0 72.69 -54.47 0.69 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.093 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -75.69 -50.23 16.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -57.16 -29.1 63.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.418 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.6 mm -60.9 -49.79 83.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.476 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.78 -23.66 63.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -75.99 -45.09 36.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.195 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.417 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.4 t80 -67.68 -25.82 65.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.902 0.382 . . . . 0.0 110.391 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.416 HG22 ' CE2' ' A' ' 46' ' ' PHE . 88.6 mt -80.92 -49.46 18.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.908 179.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.528 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -68.33 -31.48 70.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.072 179.068 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 29.7 mmmt -72.51 -42.32 64.94 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.316 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -70.35 -27.88 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.437 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.485 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 32.2 m-85 -89.01 -38.87 14.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.539 0.209 . . . . 0.0 111.502 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.62 -25.43 49.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.0 111.175 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -87.17 -11.97 48.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.193 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -110.22 -53.68 2.65 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.665 0.269 . . . . 0.0 111.21 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 52.5 m-85 -94.97 16.54 15.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.637 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.6 t30 62.61 138.68 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.55 0.214 . . . . 0.0 110.851 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.52 172.49 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.248 1.965 . . . . 0.0 112.125 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.0 m -120.97 125.61 47.82 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.134 0.574 . . . . 0.0 110.789 0.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.493 ' HB3' HD12 ' A' ' 85' ' ' LEU . 8.9 m95 -114.08 174.36 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.516 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.408 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 92.2 m-70 -157.52 92.58 1.23 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.078 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.9 t -79.24 137.71 37.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.534 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.512 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 13.8 mm -112.73 145.88 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 120.748 0.308 . . . . 0.0 111.508 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.456 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 14.1 p -123.61 75.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.684 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -178.06 -88.95 0.07 OUTLIER Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -135.29 -84.16 0.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.641 0.258 . . . . 0.0 111.318 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.479 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -151.11 12.79 0.67 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.651 -179.816 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.6 p90 -60.01 -14.86 18.26 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.425 ' HA3' ' CD1' ' A' ' 57' ' ' ILE . . . -117.14 43.47 1.63 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.013 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.7 p -97.12 63.72 1.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.887 0.375 . . . . 0.0 110.635 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -119.99 45.15 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.54 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.437 HG11 ' HB3' ' A' ' 86' ' ' PHE . 97.4 t -130.82 -38.22 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.898 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -49.61 -27.31 4.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.32 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 79.1 t60 -81.92 5.97 17.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.869 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.517 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 17.5 tp10 -114.61 -33.91 5.38 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.784 0.325 . . . . 0.0 111.456 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.687 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 18.9 m -158.96 -95.97 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.887 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 70' ' ' THR . 0.0 OUTLIER 156.36 2.23 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 178.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.43 ' CE1' ' HE2' ' A' ' 71' ' ' LYS . 20.3 m80 -79.2 60.96 3.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.162 0.506 . . . . 0.0 109.93 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 40.3 p90 -111.83 -168.14 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.926 -178.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.433 HD13 ' HA ' ' A' ' 18' ' ' GLN . 7.1 tt -168.57 148.99 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.265 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -128.19 153.15 47.22 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.006 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.587 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 19.0 p90 -170.2 123.96 0.72 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.358 0.599 . . . . 0.0 111.354 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -84.41 118.81 24.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.154 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.6 mt -116.32 117.63 30.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.716 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.48 -105.75 0.79 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.338 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -126.36 30.19 5.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 111.269 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 85.2 t -142.53 133.81 24.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.37 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.53 118.51 31.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.587 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 2.6 mp -103.11 137.04 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.009 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.508 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -137.31 116.22 12.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.168 0.509 . . . . 0.0 111.899 -179.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.493 HD12 ' HB3' ' A' ' 54' ' ' TRP . 63.9 tp -107.18 135.27 48.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.364 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.5 m-85 -130.75 176.12 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 0.0 112.24 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.444 ' CG ' ' CE2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -141.82 85.62 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.474 179.433 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.517 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 99.1 p -71.07 108.0 4.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.818 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.08 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.558 179.938 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.883 0.373 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 24.0 t -133.14 152.13 35.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.469 HG12 ' HB3' ' A' ' 76' ' ' PHE . 37.5 mt -115.74 114.95 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.509 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -75.02 -38.24 61.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.1 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.599 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 0.9 OUTLIER -164.0 119.0 1.54 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.851 0.358 . . . . 0.0 110.73 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.489 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -143.89 140.03 29.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.373 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -131.9 7.68 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.619 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.504 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 52.2 tpp -72.0 62.96 0.47 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.981 0.42 . . . . 0.0 111.409 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 42.2 t 68.34 -63.22 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.414 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.539 ' HB2' ' O ' ' A' ' 14' ' ' SER . 41.2 tt0 150.56 -49.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.702 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -52.89 -24.87 10.08 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.873 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.504 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.8 mpt? -81.85 -25.22 35.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.28 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.496 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 58.9 mt-30 -65.75 -42.27 91.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -74.94 -39.79 61.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.185 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.58 -53.81 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.908 0.385 . . . . 0.0 110.764 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.55 -51.48 65.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.309 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.454 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 70.7 t -56.46 -53.76 36.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -68.46 -23.26 64.57 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.854 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.6 -34.09 67.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.72 -27.06 44.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.827 178.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.9 m -77.06 -49.28 15.69 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.954 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -69.67 -25.6 63.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.285 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.63 -42.04 64.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.535 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.6 ttm -71.5 -31.26 66.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.738 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.35 -46.78 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.264 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -77.04 -21.47 54.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -144.37 149.43 36.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.842 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -136.85 43.22 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.029 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.6 mt -99.43 -16.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.418 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.4 mt-10 77.55 -54.81 0.53 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.005 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -75.33 -50.84 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.256 179.577 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.84 -28.12 54.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.08 0.467 . . . . 0.0 110.112 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.3 mm -61.94 -57.87 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.416 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.15 -24.46 58.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.926 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.527 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -77.81 -42.45 33.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.017 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -69.41 -21.91 63.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.3 mt -81.62 -50.36 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.485 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 18.6 ptpt -66.17 -38.64 88.55 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.662 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 1.1 mptm? -65.53 -45.87 81.77 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.58 -44.44 76.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -74.34 -32.47 62.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.389 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.406 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 47.5 m-20 -74.32 -26.69 60.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.698 0.285 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -88.74 -15.62 34.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.512 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -111.96 -26.94 8.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.537 0.208 . . . . 0.0 111.311 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.417 ' CZ ' ' HE2' ' A' ' 17' ' ' MET . 46.2 m-85 -117.96 1.94 12.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.538 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 61.73 153.46 0.11 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.69 0.281 . . . . 0.0 111.005 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 170.91 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.643 2.229 . . . . 0.0 112.145 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -117.74 119.89 36.29 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.05 0.54 . . . . 0.0 110.294 -0.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.596 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 21.9 m95 -108.63 -172.28 2.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.227 0.537 . . . . 0.0 111.596 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.433 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 15.3 t-160 -171.77 115.44 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.911 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.5 t -102.09 145.58 29.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.954 0.407 . . . . 0.0 111.33 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.478 HG21 ' CE1' ' A' ' 62' ' ' PHE . 27.3 mm -111.71 143.13 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.603 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.45 ' N ' HG22 ' A' ' 57' ' ' ILE . 7.2 p -129.88 58.91 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.566 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -148.02 -109.74 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.859 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -123.43 -65.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.86 0.362 . . . . 0.0 111.38 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.555 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.06 20.81 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.55 -179.361 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.478 ' CE1' HG21 ' A' ' 57' ' ' ILE . 15.0 p90 -76.32 17.04 0.39 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.562 -177.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.402 ' H ' ' C ' ' A' ' 61' ' ' ASN . . . -87.63 28.69 5.73 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.016 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -71.87 57.71 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.258 0.552 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.568 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 65.9 t80 -146.28 24.53 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.347 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.498 ' HA ' ' CD2' ' A' ' 86' ' ' PHE . 43.6 t -85.96 -54.99 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.774 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 89.5 m -50.91 -32.8 21.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.055 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -54.57 -23.41 16.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.217 0.532 . . . . 0.0 109.728 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -93.71 -76.34 0.48 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.219 179.06 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.508 ' OG1' ' HD2' ' A' ' 71' ' ' LYS . 1.8 t -163.45 -107.95 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.818 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.508 ' HD2' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -153.2 32.21 0.47 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.001 0.429 . . . . 0.0 110.899 179.298 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 37.9 m170 -109.24 72.16 0.8 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.451 179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' A' ' 13' ' ' MET . 30.5 p90 -106.04 -172.14 2.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.293 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.489 HG13 ' CB ' ' A' ' 11' ' ' ALA . 5.1 tt 166.37 107.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.007 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.599 ' CE2' ' HB3' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -119.24 163.68 16.75 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.162 0.506 . . . . 0.0 111.619 178.855 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 7' ' ' VAL . 5.9 p90 -155.09 162.49 41.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.742 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -119.3 133.46 55.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.053 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.413 ' O ' ' CD1' ' A' ' 78' ' ' LEU . 2.9 pp -140.47 141.0 35.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.979 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.57 -97.25 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.636 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -141.19 29.62 1.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.914 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -140.72 133.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.862 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -100.0 128.62 46.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.469 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 65.9 mt -115.51 138.26 46.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 75' ' ' TYR . 5.4 tt -130.18 117.04 19.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.612 -179.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.7 144.17 38.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.553 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.498 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 3.8 p90 -165.06 179.79 6.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.596 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -168.85 -177.98 3.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.132 0.491 . . . . 0.0 111.752 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.524 ' HA ' ' HB3' ' A' ' 69' ' ' GLU . 78.5 p -111.57 76.66 0.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.249 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.46 ' N ' ' HD3' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.511 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.888 0.375 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -141.06 104.72 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.479 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -81.81 91.63 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.916 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -57.16 -19.18 18.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.722 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 49.5 t30 179.17 130.96 0.08 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.359 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.92 130.66 53.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.594 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -132.58 3.39 3.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.451 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.494 ' HG2' ' C ' ' A' ' 73' ' ' PHE . 68.3 mmm -97.45 49.07 1.04 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.028 0.442 . . . . 0.0 111.669 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.493 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 51.1 m 70.48 -63.05 0.42 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.715 178.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.638 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 10.2 pt-20 159.23 -42.25 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.651 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -52.5 -33.2 43.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.995 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -72.64 -28.29 62.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.199 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.638 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 55.8 mm-40 -63.26 -50.14 71.31 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.54 -34.02 64.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.081 179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.444 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 39.1 t70 -74.89 -64.18 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 110.463 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.3 -46.26 46.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.32 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 53.8 t -59.29 -54.61 31.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.984 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.76 -29.07 69.89 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.636 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.32 -34.0 70.17 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -28.45 51.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.62 178.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.7 m -74.58 -51.39 14.71 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.609 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.448 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -68.1 -23.96 64.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.367 178.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.5 -46.57 63.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 93.6 mmm -70.45 -29.83 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.968 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -78.39 -47.71 17.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.356 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -75.8 -21.23 57.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.75 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -140.76 140.1 34.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.858 0.361 . . . . 0.0 111.03 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -111.02 29.28 7.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.424 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 9.5 mt -116.46 172.27 4.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -111.03 15.12 21.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.712 0.291 . . . . 0.0 111.296 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -119.48 -52.96 2.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.836 0.35 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.81 -23.51 52.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.012 0.434 . . . . 0.0 109.912 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.424 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 37.3 mm -65.57 -57.34 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.681 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.67 62.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.42 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -83.86 -41.55 17.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.966 0.412 . . . . 0.0 110.959 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.453 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -73.35 -22.55 60.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -86.39 -43.05 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.381 0.61 . . . . 0.0 109.459 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.523 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -71.66 -37.09 70.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.728 179.111 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.42 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.5 mttt -75.7 -44.03 44.21 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.3 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.443 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . 37.6 tt0 -61.69 -36.48 81.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.444 ' CZ ' ' OD2' ' A' ' 20' ' ' ASP . 7.9 m-85 -74.92 -40.62 60.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.64 0.257 . . . . 0.0 111.517 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.99 -14.46 60.23 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 45' ' ' GLU . 4.0 ptpp? -82.91 3.94 27.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.929 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -152.25 -44.79 0.1 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.444 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -78.69 -4.1 47.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.372 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 62.99 141.62 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.707 0.289 . . . . 0.0 110.709 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.9 170.67 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.366 2.044 . . . . 0.0 112.163 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.6 t -120.97 111.51 17.59 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.089 0.556 . . . . 0.0 110.576 -0.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.506 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 10.3 m95 -101.46 168.49 9.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.06 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -151.81 99.48 2.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.758 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 29.4 p -90.78 130.0 36.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.504 ' CG2' ' CZ ' ' A' ' 62' ' ' PHE . 11.9 mm -109.3 149.6 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 49.0 t -134.79 90.07 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.984 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 175.56 -74.12 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.332 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.0 mtp85 -153.11 -78.64 0.11 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.887 0.375 . . . . 0.0 111.279 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.533 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.01 24.22 0.11 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.758 -179.572 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.504 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.8 p90 -67.83 8.58 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.464 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -64.95 -67.01 2.19 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.282 -0.961 . . . . 0.0 111.945 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 24.9 m 78.55 41.04 0.11 Allowed 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.416 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 5.3 p90 -179.31 65.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.807 0.337 . . . . 0.0 111.026 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.473 ' HA ' ' CD2' ' A' ' 86' ' ' PHE . 44.6 t -97.58 -63.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.202 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -90.71 -27.94 18.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.905 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -52.68 -22.2 4.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.311 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.514 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 22.5 pt-20 -90.44 -59.56 2.15 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.225 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.552 HG21 ' HA ' ' A' ' 88' ' ' SER . 4.6 t -147.4 -112.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 179.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.469 ' H ' ' CG2' ' A' ' 70' ' ' THR . 0.0 OUTLIER -166.58 33.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.078 0.466 . . . . 0.0 110.261 179.466 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -120.48 76.36 1.18 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.129 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.516 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 30.9 p90 -126.99 151.07 49.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.673 -178.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.453 ' HB ' ' HB2' ' A' ' 13' ' ' MET . 7.9 tt -133.6 128.43 54.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 178.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.516 ' CE2' ' CE2' ' A' ' 73' ' ' PHE . 32.5 m-85 -112.74 138.91 48.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.227 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.507 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 16.7 p90 -162.88 129.64 3.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.235 0.541 . . . . 0.0 110.955 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -92.36 150.15 21.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.5 mt -149.21 130.5 14.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.937 0.399 . . . . 0.0 111.104 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.08 -98.47 0.03 OUTLIER Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.916 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -136.14 31.87 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 0.0 110.85 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 60.8 t -148.61 137.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.972 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.43 133.96 41.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.022 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.507 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 68.1 mt -117.78 138.14 49.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.478 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.472 ' CD2' ' HB ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -133.93 103.41 5.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 0.0 111.368 -179.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 44.8 tp -96.39 108.46 20.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.594 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.473 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.6 p90 -132.81 142.75 49.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.182 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.506 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -123.24 150.99 42.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.627 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.552 ' HA ' HG21 ' A' ' 70' ' ' THR . 82.7 p -93.64 165.36 12.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.525 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.784 0.326 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.4 t -149.7 153.69 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.006 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.454 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 59.6 mt -130.42 115.79 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.043 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.03 -30.65 34.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.711 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -159.03 133.37 7.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.98 128.57 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.134 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -122.32 -16.01 7.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.523 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 17' ' ' MET . 50.3 tpp -88.53 50.56 1.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.106 0.479 . . . . 0.0 111.822 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.614 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 49.7 m 67.79 -65.25 0.25 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.821 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.648 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 tm-20 166.74 -36.18 0.0 OUTLIER 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.567 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 17' ' ' MET . 2.7 p30 -51.35 -40.78 59.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.805 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 44.8 ttm -72.24 -18.59 61.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.503 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.648 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 71.8 mm-40 -66.51 -48.4 69.91 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -69.8 -38.61 76.68 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.863 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -72.15 -63.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.211 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.15 -44.92 32.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.316 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.479 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 55.4 t -60.6 -53.31 50.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.035 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.71 -29.85 71.03 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.694 0.283 . . . . 0.0 110.733 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 73.1 m -71.78 -31.46 66.63 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.44 -24.31 31.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.056 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.1 m -80.68 -42.57 21.8 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -75.36 -29.0 59.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.064 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.85 -47.24 60.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.523 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.3 -23.61 59.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.763 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -77.37 -51.12 11.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.4 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -81.34 -24.78 36.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.083 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -135.35 168.85 18.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -159.14 44.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.066 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.5 mt -96.83 -16.68 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.5 mt-10 79.38 -53.07 0.42 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.095 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.499 ' HD3' ' N ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -79.6 -42.36 25.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.615 0.245 . . . . 0.0 110.863 -179.433 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.499 ' N ' ' HD3' ' A' ' 36' ' ' LYS . 52.6 m-20 -68.86 -17.99 64.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.022 0.439 . . . . 0.0 110.222 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 mm -72.38 -54.06 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.4 -26.93 63.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.978 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -78.16 -38.11 44.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.61 -24.69 64.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.968 0.413 . . . . 0.0 110.341 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 42' ' ' ILE . 84.3 mt -77.84 -53.28 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.755 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 64.7 pttt -66.02 -35.88 81.75 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.657 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 14.0 tppt? -61.66 -47.23 86.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -58.75 -52.47 65.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.265 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 17' ' ' MET . 13.2 m-85 -67.77 -29.44 68.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -70.7 -26.62 63.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.021 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.463 ' NZ ' ' HB3' ' A' ' 48' ' ' LYS . 7.2 ttpm? -89.85 -27.47 19.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -95.55 -50.45 4.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.144 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -91.67 9.3 32.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.371 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 60.69 154.25 0.1 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-O 120.782 0.325 . . . . 0.0 110.901 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 172.12 1.82 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.571 2.181 . . . . 0.0 112.055 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 t -121.96 97.11 5.33 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.957 0.503 . . . . 0.0 110.651 -0.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.458 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 13.6 m95 -90.46 172.16 8.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 77.5 t60 -155.06 105.26 2.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.588 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.0 t -75.48 145.96 41.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.164 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.522 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 35.9 mm -111.89 145.46 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.885 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.499 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 9.6 p -133.53 63.82 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 121.246 0.546 . . . . 0.0 111.503 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -157.1 -92.47 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.448 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -125.75 -84.85 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.715 0.293 . . . . 0.0 111.088 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.474 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -158.72 15.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.47 -179.811 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.522 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 9.7 p90 -53.97 -46.13 71.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.826 0.346 . . . . 0.0 111.353 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.423 ' HA3' HG23 ' A' ' 66' ' ' VAL . . . 79.47 -21.28 4.51 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.626 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 26.3 t 70.69 -53.43 0.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.915 0.358 . . . . 0.0 111.123 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -164.88 69.66 0.16 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.124 0.487 . . . . 0.0 111.256 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.468 HG22 ' CD2' ' A' ' 86' ' ' PHE . 42.1 t -91.26 -74.95 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.326 -179.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.8 m -43.6 -29.4 0.48 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 75.4 m-70 -44.97 -26.77 0.46 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 12.2 pt-20 167.43 50.14 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.97 0.414 . . . . 0.0 111.158 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.507 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 35.7 m -102.93 -86.89 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.444 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.1 OUTLIER 72.44 -18.24 0.34 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.333 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.45 ' H ' ' C ' ' A' ' 70' ' ' THR . 53.3 m170 -122.23 77.33 1.39 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.738 0.304 . . . . 0.0 110.286 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.438 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 6.4 p90 -125.43 -172.27 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.047 0.451 . . . . 0.0 111.434 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.526 HG13 HE22 ' A' ' 18' ' ' GLN . 9.5 tt -157.8 129.7 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.259 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.539 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 8.2 m-30 -106.63 130.78 54.32 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.518 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.457 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 2.8 p90 -152.73 123.26 7.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.238 0.542 . . . . 0.0 111.411 179.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -93.2 140.7 29.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.721 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.485 ' N ' ' CD2' ' A' ' 78' ' ' LEU . 1.3 pt? -154.17 138.04 16.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.97 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.89 -100.82 0.59 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.541 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -140.99 23.68 2.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.737 0.303 . . . . 0.0 111.003 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 61.1 t -150.78 150.02 13.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.125 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.76 130.47 44.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.018 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.483 HG22 ' O ' ' A' ' 57' ' ' ILE . 66.0 mt -110.34 137.7 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.539 ' HG ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 tt -129.57 119.6 23.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 111.539 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.3 tp -109.61 119.75 40.36 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 55' ' ' HIS . 6.3 p90 -136.87 173.08 12.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.438 0.637 . . . . 0.0 112.45 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -134.9 84.53 2.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.464 179.024 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 80.0 p -72.22 68.22 0.72 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.463 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.432 -1.204 . . . . 0.0 112.447 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.3 t -134.05 147.01 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.04 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 18' ' ' GLN . 25.7 mt -121.64 112.85 36.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.469 ' NZ ' ' HB3' ' A' ' 9' ' ' LYS . 3.3 mmmp? -66.53 -43.31 85.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.719 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.551 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 49.8 t30 -161.39 138.91 8.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.12 94.99 2.94 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.385 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 33.5 t70 -80.58 -1.74 43.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.653 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.417 ' HG3' ' N ' ' A' ' 14' ' ' SER . 47.8 tpp -86.18 165.13 16.78 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.417 ' N ' ' HG3' ' A' ' 13' ' ' MET . 80.4 p -36.4 -81.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.757 0.313 . . . . 0.0 111.818 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.411 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 12.0 pt-20 176.76 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.207 0.527 . . . . 0.0 110.184 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -56.8 -24.6 51.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.582 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -80.06 -28.29 39.24 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.448 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.465 ' HB3' ' CD1' ' A' ' 8' ' ' ILE . 57.0 mt-30 -65.18 -47.08 78.25 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -77.25 -35.43 55.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.212 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.446 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.4 t70 -71.07 -53.33 15.05 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.265 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.66 -49.86 67.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.0 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.429 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 80.1 t -54.65 -49.87 64.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.099 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -71.36 -27.31 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.022 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 95.3 m -71.79 -33.49 68.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.75 39.13 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.968 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.5 m -79.17 -45.75 19.29 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.904 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -73.69 -25.28 60.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.279 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.96 -53.26 13.58 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 66.2 mtt -73.48 -20.7 60.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.101 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -78.04 -50.67 11.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.879 0.371 . . . . 0.0 110.741 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -81.99 -23.61 35.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.141 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -131.89 165.91 22.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.85 0.357 . . . . 0.0 111.05 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -156.02 35.88 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.998 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.467 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 29.7 mt -98.3 -10.58 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.519 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 78.12 -55.1 0.5 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.105 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.42 -53.04 26.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.676 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.81 -25.39 55.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 38' ' ' ILE . 45.3 mm -65.63 -55.86 17.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.499 179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.32 -23.39 64.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.985 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -80.24 -39.0 29.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.851 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.27 -27.16 66.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.406 . . . . 0.0 110.088 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.418 HD13 HG21 ' A' ' 42' ' ' ILE . 76.2 mt -80.85 -48.67 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.652 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -67.23 -31.77 72.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.086 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.1 mttt -80.48 -29.43 37.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.1 -39.5 78.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.823 0.344 . . . . 0.0 111.167 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.477 ' CE2' ' CD2' ' A' ' 85' ' ' LEU . 3.8 m-85 -82.05 -36.09 28.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.257 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.07 -17.63 56.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 21.8 ptmt -85.59 3.79 39.12 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.446 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 49' ' ' LYS . 10.4 mtmp? -142.7 -48.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.926 0.393 . . . . 0.0 110.829 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -87.51 6.26 35.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 60.59 156.07 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-O 120.727 0.299 . . . . 0.0 110.721 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 39.8 Cg_exo -56.65 167.03 3.13 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.394 2.063 . . . . 0.0 112.053 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.0 t -139.08 126.98 22.21 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.241 0.616 . . . . 0.0 110.565 0.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.711 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 1.3 m95 -112.19 -171.28 1.82 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.292 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.494 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 50.1 m80 -157.39 58.2 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.281 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.0 t -48.91 133.52 17.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.673 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 83' ' ' ILE . 30.9 mm -106.05 142.21 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.687 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 10.9 p -129.73 72.16 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.477 -179.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.66 -92.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.145 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 11.5 mtp-105 -157.59 67.24 0.5 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.653 0.263 . . . . 0.0 110.894 -179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.504 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER 52.15 12.9 0.24 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.394 179.756 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.444 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 5.8 p90 -51.67 -25.87 8.05 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.311 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.412 ' N ' ' CD1' ' A' ' 62' ' ' PHE . . . -121.29 48.06 0.98 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.701 179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -77.6 56.63 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.539 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -98.73 37.7 1.46 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 0.0 110.448 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.453 ' CG1' ' HB3' ' A' ' 73' ' ' PHE . 66.2 t -46.15 -54.26 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.597 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -50.8 -32.54 20.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.052 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -53.65 -24.01 12.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 88' ' ' SER . 9.5 mp0 -92.78 -77.51 0.44 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.598 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.49 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 1.8 t -176.55 -95.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.845 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.49 ' H ' ' CG2' ' A' ' 70' ' ' THR . 2.4 mptp? -152.79 22.62 0.59 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -113.12 73.7 0.83 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.987 0.422 . . . . 0.0 110.856 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.502 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 5.8 p90 -113.68 -179.87 3.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.801 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.427 ' N ' ' HD1' ' A' ' 73' ' ' PHE . 7.7 tt 176.39 108.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.998 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.551 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 1.1 p90 -113.64 162.57 16.08 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.23 0.538 . . . . 0.0 111.513 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 76' ' ' PHE . 1.3 p90 -153.38 159.05 42.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.111 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.403 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 1.4 t80 -109.78 121.5 45.36 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.96 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.403 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 78.7 mt -119.86 112.26 18.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.053 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.41 -90.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.75 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -138.42 31.89 2.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.909 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.6 t -146.55 126.14 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.09 134.9 37.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.27 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.495 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 68.7 mt -115.43 135.8 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.651 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.428 ' HG ' ' CD2' ' A' ' 86' ' ' PHE . 52.1 tp -124.36 107.01 10.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.477 ' CD2' ' CE2' ' A' ' 46' ' ' PHE . 59.8 tp -108.64 130.61 55.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.561 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.502 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 2.9 p90 -157.54 151.85 24.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.336 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.711 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -127.92 152.87 47.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.244 0.545 . . . . 0.0 111.774 -179.604 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.557 ' HB2' ' HA ' ' A' ' 69' ' ' GLU . 33.1 t -100.57 77.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.288 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.465 ' N ' ' HD2' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.406 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.434 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.413 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.504 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.504 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.676 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.408 ' O ' ' CB ' ' A' ' 21' ' ' ALA . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.676 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 24' ' ' CYS . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' ASP . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.403 ' CE ' HG13 ' A' ' 58' ' ' VAL . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.42 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CZ3' ' HB2' ' A' ' 87' ' ' LYS . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.491 ' O ' HG21 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.403 HG13 ' CE ' ' A' ' 29' ' ' MET . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.619 ' O ' ' HB3' ' A' ' 61' ' ' ASN . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.619 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.51 ' N ' HD21 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.421 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.417 HG22 ' CE1' ' A' ' 86' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.526 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.526 ' H ' ' CG2' ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.477 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.47 ' CE2' ' CD1' ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.483 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.434 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.434 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.491 HG21 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.476 HD22 ' HB ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.621 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' HG23 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.799 0.333 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.8 p -59.42 117.2 4.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.963 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -177.66 100.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.084 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.439 ' HD2' ' N ' ' A' ' 4' ' ' ARG . 10.2 mpt_? -103.88 -177.93 3.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.59 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.39 50.38 2.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.78 115.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -155.29 96.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.1 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.428 HG21 HD13 ' A' ' 8' ' ' ILE . 69.0 mt -79.21 112.43 17.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.948 0.404 . . . . 0.0 110.994 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -80.97 -32.36 34.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.933 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -168.45 114.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.619 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.41 ' CB ' ' NE2' ' A' ' 18' ' ' GLN . . . -112.49 117.96 33.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.452 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.87 -13.68 18.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.844 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.502 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 41.9 tpp -75.32 170.91 15.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.377 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.0 t -73.38 38.01 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.535 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 92.0 mt-10 68.65 -43.91 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -45.39 -40.22 7.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.619 0.247 . . . . 0.0 111.64 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.502 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -71.91 -26.42 62.3 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.16 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.535 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 60.9 mt-30 -64.79 -42.62 94.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -77.09 -40.13 47.14 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.183 178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -70.98 -57.67 4.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.379 . . . . 0.0 110.907 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.428 ' CB ' ' CE2' ' A' ' 76' ' ' PHE . . . -55.21 -49.83 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.534 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.493 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 61.3 t -57.66 -44.82 86.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.352 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -73.96 -30.63 62.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 85.7 m -71.97 -32.99 67.8 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 29' ' ' MET . . . -80.93 -24.91 37.85 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.252 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.4 m -81.25 -43.83 18.63 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.995 0.426 . . . . 0.0 109.925 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -74.87 -26.27 59.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.384 179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -78.56 -39.39 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.094 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 25' ' ' ALA . 27.4 ptt? -77.21 -26.86 53.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.482 ' OE2' ' HB2' ' A' ' 31' ' ' LYS . 0.8 OUTLIER -87.01 -37.66 17.3 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.482 ' HB2' ' OE2' ' A' ' 30' ' ' GLU . 24.3 ttmm -79.21 -28.31 42.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.203 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -146.73 176.28 9.98 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.803 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -158.04 27.49 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.173 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.464 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 35.6 mm -75.35 -13.03 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.549 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 42.9 mt-10 76.56 -54.46 0.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.036 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -74.81 -50.15 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.94 0.4 . . . . 0.0 110.572 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -56.26 -29.6 61.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.15 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.3 mm -62.3 -56.06 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.634 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.75 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.25 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.465 ' O ' ' CB ' ' A' ' 44' ' ' LYS . . . -78.66 -41.49 31.15 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.78 -26.36 65.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.1 mt -80.32 -48.27 20.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.942 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.427 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 2.7 pptp? -69.69 -32.67 71.42 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.764 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 51.9 tttp -68.24 -44.98 74.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.939 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.73 -43.4 98.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.1 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.16 -16.71 52.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.615 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -87.0 -43.02 12.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.795 0.331 . . . . 0.0 111.115 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -90.26 21.77 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.649 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -138.0 -42.87 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.659 0.266 . . . . 0.0 111.226 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -111.29 10.6 21.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.664 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 62.5 142.72 0.06 OUTLIER Pre-proline 0 CA--C 1.529 0.165 0 CA-C-O 120.638 0.256 . . . . 0.0 110.898 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -50.0 173.91 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.339 2.026 . . . . 0.0 112.358 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -125.15 112.28 16.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.015 0.526 . . . . 0.0 110.611 -0.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.526 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 7.1 m95 -102.32 -167.29 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.802 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -176.14 90.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.8 t -89.19 144.32 26.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.491 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.498 ' CG2' ' CZ ' ' A' ' 62' ' ' PHE . 9.2 mm -115.15 150.94 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.66 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.492 ' HA ' HG12 ' A' ' 83' ' ' ILE . 47.7 t -137.42 91.66 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.267 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.77 -83.55 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.218 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.0 mtm-85 -140.97 -75.86 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.38 . . . . 0.0 111.137 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.529 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -161.07 23.1 0.13 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.895 -179.645 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.7 p90 -71.91 2.47 5.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -177.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.81 -58.6 13.72 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m 44.69 54.01 6.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.477 ' CG ' ' O ' ' A' ' 65' ' ' TYR . 37.8 t80 -165.77 31.6 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.745 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.456 ' HA ' ' CD2' ' A' ' 86' ' ' PHE . 59.7 t -84.6 -72.77 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.396 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.6 m -69.64 -26.07 64.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.996 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -46.62 -25.29 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.847 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 17.1 pt-20 -103.88 -63.6 1.18 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.709 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.478 ' C ' ' HD2' ' A' ' 71' ' ' LYS . 2.6 t -150.94 -116.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.478 ' HD2' ' C ' ' A' ' 70' ' ' THR . 7.5 mptt -154.29 30.61 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.685 0.278 . . . . 0.0 110.954 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -105.94 68.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.871 0.367 . . . . 0.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.46 ' CE1' ' CE2' ' A' ' 75' ' ' TYR . 5.6 p90 -117.74 175.5 5.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.176 0.512 . . . . 0.0 111.434 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.473 HD12 ' HA ' ' A' ' 18' ' ' GLN . 9.4 tt -160.4 110.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.359 178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.46 ' CE2' ' CE1' ' A' ' 73' ' ' PHE . 66.4 m-85 -91.4 140.04 30.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.921 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.625 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 24.8 p90 -161.14 121.0 2.65 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 110.079 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.463 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 31.6 t80 -92.6 139.22 30.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.949 -177.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.43 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -111.5 162.98 14.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.89 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -51.79 100.14 0.05 OUTLIER Glycine 0 CA--C 1.521 0.418 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.423 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.46 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 71.85 25.09 3.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.149 0.499 . . . . 0.0 110.685 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.463 ' O ' ' CD1' ' A' ' 77' ' ' TYR . 95.9 t -155.54 158.82 3.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.924 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -132.42 143.12 49.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.704 179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.625 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 54.0 mt -140.16 137.78 37.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.724 0.297 . . . . 0.0 110.68 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.422 ' CD2' ' N ' ' A' ' 84' ' ' LEU . 0.3 OUTLIER -138.12 115.67 11.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.449 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 56.1 tp -102.18 130.73 48.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.629 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.456 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.3 p90 -151.67 157.71 42.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.526 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -146.62 162.67 37.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.942 -179.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' A' ' 69' ' ' GLU . 93.4 p -94.07 167.8 11.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.054 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.528 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.786 0.327 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.3 t -159.52 125.08 4.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.848 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.581 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 67.0 t0 -93.36 48.16 1.3 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.954 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 68.1 mtp180 78.36 108.79 0.07 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.29 0.567 . . . . 0.0 110.386 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.484 ' O ' ' HG2' ' A' ' 5' ' ' LYS . 86.5 tttt -121.86 27.68 7.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.169 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 169.22 103.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.254 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.8 t -148.79 107.98 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.41 ' CD1' ' OE1' ' A' ' 18' ' ' GLN . 68.4 mt -86.05 115.85 28.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.899 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -84.84 -31.08 24.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.621 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -171.9 112.08 0.3 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -132.06 105.94 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.036 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.426 ' OD1' ' CD1' ' A' ' 73' ' ' PHE . 12.6 p-10 -77.63 -4.41 45.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.245 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.476 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.3 tpp -75.02 165.77 24.73 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' CG ' ' A' ' 15' ' ' GLU . 79.8 p -50.54 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.631 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 47.4 mt-10 -162.99 -36.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.55 0.691 . . . . 0.0 110.194 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.53 -27.64 57.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.476 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.9 mpt? -77.67 -25.35 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.441 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.631 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 41.2 mm-40 -65.51 -50.12 66.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -77.48 -32.47 54.36 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.688 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -73.64 -50.4 21.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.858 0.361 . . . . 0.0 110.602 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -59.82 -47.77 84.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.315 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.431 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 98.8 t -58.76 -51.61 69.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.066 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.21 -28.39 65.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.556 0.217 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 24.7 t -71.48 -32.34 68.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.01 -25.55 37.12 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.115 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.1 m -79.55 -45.11 19.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.119 0.485 . . . . 0.0 109.811 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.503 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.5 mt-30 -73.12 -26.34 61.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.324 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.67 -39.96 50.49 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.075 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -73.1 -32.33 64.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 12.4 pt-20 -80.58 -45.28 17.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.104 0.478 . . . . 0.0 109.758 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 57.0 tptt -71.52 -20.82 61.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -142.49 133.14 25.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.903 0.382 . . . . 0.0 111.088 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -102.72 29.94 5.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.492 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.444 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 9.8 mt -115.11 168.79 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -113.24 18.87 17.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.524 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.415 ' HG2' HG21 ' A' ' 34' ' ' ILE . 65.0 pttt -125.97 -44.39 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.732 0.301 . . . . 0.0 110.223 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -68.2 -17.09 64.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.444 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 40.1 mm -69.63 -51.76 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.399 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.78 -22.16 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.108 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.442 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.66 -38.89 25.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.419 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -70.54 -26.31 63.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.19 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 78.6 mt -84.01 -43.85 17.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 62.8 tttp -67.26 -35.6 79.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.64 178.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 26.6 tptp -68.86 -59.89 2.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.387 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.415 ' HG3' ' CE1' ' A' ' 41' ' ' TYR . 5.4 mm-40 -49.57 -51.72 35.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.89 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.508 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 14.6 m-85 -67.75 -31.23 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.395 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -73.58 -26.27 60.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 0.0 110.794 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -90.05 -24.77 21.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.98 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -95.76 -57.91 2.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.202 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.417 ' CZ ' ' HE1' ' A' ' 17' ' ' MET . 47.8 m-85 -94.69 17.05 14.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 58.98 161.17 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.33 170.2 15.29 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.602 2.201 . . . . 0.0 111.922 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.0 m -124.5 104.73 8.89 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.282 0.633 . . . . 0.0 110.572 -0.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.476 ' HB3' HD13 ' A' ' 85' ' ' LEU . 7.3 m95 -99.9 -171.11 1.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.59 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 77.9 t60 -179.98 85.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.955 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.8 t -66.65 153.28 43.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.861 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.49 ' O ' ' CG2' ' A' ' 83' ' ' ILE . 19.6 mm -118.16 138.73 47.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.282 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.564 ' HA ' HG12 ' A' ' 83' ' ' ILE . 14.6 p -119.48 62.39 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.46 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.68 -92.73 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.597 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 79.0 mtt-85 -144.94 -65.25 0.34 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.0 111.349 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.508 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.87 19.3 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.843 -179.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.442 ' CE1' HG22 ' A' ' 57' ' ' ILE . 5.5 p90 -67.49 5.16 0.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.14 57.82 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.878 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.9 m -69.08 55.47 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.027 0.441 . . . . 0.0 111.662 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.436 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 4.7 m-85 -99.22 35.11 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.55 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.452 ' O ' ' HB ' ' A' ' 70' ' ' THR . 44.2 t -98.48 -1.34 10.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.791 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.9 m -115.55 -27.7 7.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 0.0 111.043 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.555 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 36.1 m80 -50.12 -26.43 4.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.242 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.555 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 22.6 pt-20 156.66 45.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 120.889 0.376 . . . . 0.0 110.975 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 20.0 m -94.04 -84.05 0.32 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.481 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.3 OUTLIER 74.84 -12.41 0.94 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.536 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.422 ' CD2' ' HE1' ' A' ' 13' ' ' MET . 9.0 t-160 -139.02 82.87 1.92 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.523 ' HD1' ' N ' ' A' ' 74' ' ' ILE . 7.7 p90 -110.51 -172.3 2.0 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.085 0.469 . . . . 0.0 111.753 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.523 ' N ' ' HD1' ' A' ' 73' ' ' PHE . 5.5 tt -160.93 113.16 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.749 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.457 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 8.1 m-30 -100.94 153.72 19.28 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.484 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.496 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 20.6 p90 -170.27 137.49 1.5 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.721 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -93.67 134.24 36.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.158 -178.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 81.4 mt -131.72 125.44 32.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.84 -110.94 1.42 Allowed Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.086 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.554 ' HA ' ' NE2' ' A' ' 80' ' ' GLN . 5.0 mm100 -128.61 49.65 2.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.346 0.593 . . . . 0.0 110.603 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.423 ' CG2' ' O ' ' A' ' 80' ' ' GLN . 91.7 t -160.2 138.61 2.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.638 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -83.91 134.06 34.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.272 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.564 HG12 ' HA ' ' A' ' 58' ' ' VAL . 63.3 mt -135.69 133.41 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.478 HD23 HG12 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -148.87 143.89 26.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.743 -0.783 . . . . 0.0 112.474 -179.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.508 ' CD2' ' CD2' ' A' ' 46' ' ' PHE . 61.1 tp -116.81 155.99 28.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.271 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.438 ' CE1' ' O ' ' A' ' 55' ' ' HIS . 10.9 p90 -164.3 158.68 19.04 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 0.0 111.977 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.431 ' HB2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -108.25 76.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.737 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 81.2 p -74.91 73.97 2.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.407 -1.219 . . . . 0.0 112.56 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.518 ' HA ' ' CE ' ' A' ' 1' ' ' MET . 10.4 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.862 0.363 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t 60.04 31.67 20.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 62.29 90.26 0.08 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.946 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -124.88 42.68 3.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.672 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -113.9 50.01 0.95 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.434 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . 67.27 108.86 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.21 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.413 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.504 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.504 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.676 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.408 ' O ' ' CB ' ' A' ' 21' ' ' ALA . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.676 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 24' ' ' CYS . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' ASP . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.403 ' CE ' HG13 ' A' ' 58' ' ' VAL . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.42 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CZ3' ' HB2' ' A' ' 87' ' ' LYS . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.491 ' O ' HG21 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.403 HG13 ' CE ' ' A' ' 29' ' ' MET . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.619 ' O ' ' HB3' ' A' ' 61' ' ' ASN . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.619 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.51 ' N ' HD21 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.421 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.417 HG22 ' CE1' ' A' ' 86' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.526 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.526 ' H ' ' CG2' ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.477 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.47 ' CE2' ' CD1' ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.483 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.434 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.491 HG21 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.476 HD22 ' HB ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.621 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' HG23 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.885 0.374 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t -139.58 161.32 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.7 t0 60.41 76.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.693 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 50.3 mtp85 -103.07 -41.09 6.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.825 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 44.02 48.72 7.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.402 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . -177.98 100.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.9 155.17 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.992 0.425 . . . . 0.0 111.635 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.49 ' CD1' ' HB3' ' A' ' 18' ' ' GLN . 77.6 mt -130.11 123.19 55.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.668 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -87.14 -31.93 20.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.442 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -178.99 110.92 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.607 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.1 144.95 20.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.191 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.486 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.3 t70 -143.47 18.22 1.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.61 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.478 ' CG ' ' HG3' ' A' ' 17' ' ' MET . 50.3 tpp -69.5 65.65 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.69 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 47.1 t 56.97 12.7 1.27 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.545 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 47.6 mt-10 69.35 -49.77 0.61 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -46.31 -36.16 6.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.646 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.478 ' HG3' ' CG ' ' A' ' 13' ' ' MET . 21.8 mmt -75.84 -24.41 55.81 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.769 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.545 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 64.9 mt-30 -67.02 -41.7 86.16 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -82.53 -34.54 27.86 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.021 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' OD1' ' A' ' 23' ' ' ASP . 7.8 t0 -74.81 -37.76 62.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.154 0.502 . . . . 0.0 110.527 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.462 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -71.01 -45.66 63.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.708 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.474 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 73.9 t -59.43 -55.11 25.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.266 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 20' ' ' ASP . 57.7 p30 -67.25 -25.23 65.98 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.057 -0.257 . . . . 0.0 110.987 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 54.1 t -72.46 -36.53 68.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -75.12 -26.33 59.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.645 178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -76.65 -53.97 7.3 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.745 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.419 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -63.4 -24.57 67.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.451 178.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.02 58.42 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.64 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.6 ptp -75.75 -24.6 56.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.131 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -79.35 -51.01 9.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.0 110.075 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -72.16 -27.12 62.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.575 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -135.3 146.79 48.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.753 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -134.44 42.57 2.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.027 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.5 mt -101.43 -13.31 8.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.555 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.9 mt-10 76.85 -54.51 0.57 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.212 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -71.98 -56.03 6.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.485 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -55.07 -25.49 31.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.249 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.61 -49.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.38 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -65.15 -22.58 66.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.161 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.74 -40.42 22.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.403 ' O ' ' CD1' ' A' ' 41' ' ' TYR . 5.4 t80 -68.36 -28.35 67.05 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.33 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.5 mt -77.36 -49.92 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.985 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.52 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.6 ptmt -65.34 -36.26 83.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.7 tptm -55.24 -55.55 30.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.65 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.06 -54.97 38.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.839 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.411 ' CE1' ' OD1' ' A' ' 20' ' ' ASP . 7.8 m-85 -63.54 -20.05 65.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.263 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -74.44 -56.31 4.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.656 0.265 . . . . 0.0 111.255 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -87.0 7.81 26.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.757 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -114.37 -29.89 6.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 111.025 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CZ ' ' CE ' ' A' ' 17' ' ' MET . 48.6 m-85 -130.37 6.55 4.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.42 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.53 150.63 0.1 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-O 120.636 0.255 . . . . 0.0 111.049 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -56.92 172.55 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.526 2.151 . . . . 0.0 112.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -121.97 126.4 48.49 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.105 0.562 . . . . 0.0 110.709 -0.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.458 ' N ' ' CD1' ' A' ' 54' ' ' TRP . 3.6 m95 -122.29 172.17 8.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.758 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -149.74 81.62 1.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.327 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 31.2 p -72.9 138.38 46.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.476 HG21 ' CE1' ' A' ' 62' ' ' PHE . 29.2 mm -109.04 147.15 13.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.379 179.274 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.47 ' N ' HG22 ' A' ' 57' ' ' ILE . 52.9 t -129.44 74.27 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.41 ' HA2' ' CG1' ' A' ' 81' ' ' VAL . . . 178.94 -100.16 0.14 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.383 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -126.68 -77.1 0.58 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 120.881 0.372 . . . . 0.0 110.882 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.489 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.53 19.44 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.091 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.476 ' CE1' HG21 ' A' ' 57' ' ' ILE . 8.1 p90 -58.62 -15.53 12.0 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.62 54.26 0.76 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.46 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.446 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 41.0 t -60.88 -95.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 36.9 p90 41.71 37.87 0.83 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.476 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.452 ' CG2' ' CE1' ' A' ' 86' ' ' PHE . 47.6 t -60.07 -39.04 79.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.1 m -68.94 -29.13 67.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -49.79 -26.09 3.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 110.27 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.492 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 8.8 mp0 -82.01 -77.25 0.23 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.416 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.516 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 1.2 t -172.42 -86.63 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.272 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.516 ' H ' ' CG2' ' A' ' 70' ' ' THR . 1.5 tptm -166.95 29.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.214 0.53 . . . . 0.0 109.841 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.406 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 93.4 m-70 -129.29 81.27 2.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.618 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.491 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 5.9 p90 -112.7 179.06 4.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.929 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.466 HG23 ' O ' ' A' ' 74' ' ' ILE . 8.0 tt -162.29 111.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.457 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.434 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 7.0 m-30 -100.61 151.03 22.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.495 ' CZ ' HG21 ' A' ' 83' ' ' ILE . 1.7 p90 -168.18 116.4 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.967 0.413 . . . . 0.0 110.802 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -84.7 141.14 30.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.89 -179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.403 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 80.0 mt -139.05 135.8 34.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.18 -93.15 0.01 OUTLIER Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.761 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.409 ' OE1' ' CG2' ' A' ' 81' ' ' VAL . 0.0 OUTLIER -139.93 20.9 2.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.688 0.28 . . . . 0.0 111.608 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.41 ' CG1' ' HA2' ' A' ' 59' ' ' GLY . 92.3 t -140.26 129.95 28.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.87 0.367 . . . . 0.0 110.862 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -89.08 128.53 35.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.818 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.495 HG21 ' CZ ' ' A' ' 76' ' ' PHE . 59.7 mt -104.11 135.87 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.844 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.564 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 10.2 mp -122.42 107.45 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.609 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 74' ' ' ILE . 65.4 tp -110.01 120.35 42.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.872 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.564 ' CE1' ' HB3' ' A' ' 84' ' ' LEU . 1.5 m-85 -111.1 165.14 12.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.868 0.366 . . . . 0.0 111.055 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.455 ' HG2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -136.44 117.72 14.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.659 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.492 ' CA ' ' HB3' ' A' ' 69' ' ' GLU . 46.1 t -98.41 151.81 20.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.913 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.404 ' N ' HG22 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.537 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 mmt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.805 0.336 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 t -89.65 111.75 22.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -161.93 30.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 4' ' ' ARG . 5.0 mmp_? -107.08 -73.73 0.68 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.85 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 58.24 91.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.799 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 62.25 98.46 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.023 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.497 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 55.4 t -143.83 138.83 25.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.096 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.483 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 2.1 mp -103.97 136.44 37.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.206 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 61.7 mttp -94.28 29.0 2.32 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.577 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.499 ' HB3' ' O ' ' A' ' 9' ' ' LYS . 45.1 t30 87.68 106.68 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.328 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.439 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -126.88 179.05 5.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.05 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -168.6 19.22 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.521 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 44.8 ttp -80.35 62.88 4.63 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.206 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 45.6 m 72.55 1.57 4.03 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 14' ' ' SER . 46.7 mt-10 70.5 -51.18 0.66 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.783 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -48.26 -29.25 3.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.945 0.402 . . . . 0.0 110.326 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.443 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.0 OUTLIER -72.72 -29.86 63.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.464 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.48 ' N ' HD11 ' A' ' 74' ' ' ILE . 65.6 mt-30 -65.29 -38.33 89.89 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -73.63 -44.43 57.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.39 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.71 -54.33 9.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.258 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.35 -52.1 64.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.425 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.468 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 78.1 t -57.6 -50.56 76.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.036 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.3 m-20 -69.79 -24.75 63.54 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.787 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -71.75 -38.05 70.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.62 -23.02 53.38 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.779 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.3 m -78.92 -50.88 10.47 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.515 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 23.9 pt20 -69.74 -23.92 63.46 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.373 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.88 -43.49 35.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.062 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.739 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.515 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.3 pt-20 -84.25 -43.95 14.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.049 0.452 . . . . 0.0 109.932 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -74.2 -21.02 59.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.41 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 2.3 m-85 -131.28 -172.24 2.79 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.701 0.286 . . . . 0.0 110.808 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -173.97 35.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.807 0.337 . . . . 0.0 111.122 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.2 mt -99.41 -18.07 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 67.45 11.86 8.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.305 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -129.07 -54.44 1.2 Allowed 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -58.7 -23.03 58.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.406 HD11 HG23 ' A' ' 38' ' ' ILE . 44.3 mm -61.37 -58.55 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.359 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.55 -21.21 65.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.937 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.45 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -81.81 -41.57 20.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.985 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -70.15 -22.82 62.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.809 0.338 . . . . 0.0 110.582 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.423 HG23 HD11 ' A' ' 42' ' ' ILE . 96.9 mt -82.31 -48.45 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 23.5 pttm -70.47 -33.75 71.62 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.842 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 59.1 mtpt -72.49 -38.42 68.16 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -61.71 -40.81 96.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 110.431 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.45 ' CE2' ' CD2' ' A' ' 85' ' ' LEU . 4.5 m-85 -81.51 -36.73 28.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.396 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -75.03 -26.62 59.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.664 0.269 . . . . 0.0 111.369 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -90.24 29.52 1.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.813 0.339 . . . . 0.0 111.212 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -155.0 -44.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.678 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -106.94 -4.89 18.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.461 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.418 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 74.0 m-80 63.53 162.33 0.12 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-O 120.647 0.261 . . . . 0.0 111.122 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 79.6 Cg_exo -46.32 173.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.826 2.351 . . . . 0.0 112.38 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 66.7 p -119.24 115.08 23.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.232 0.613 . . . . 0.0 110.629 -0.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.64 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 1.1 m95 -114.62 -174.13 2.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.136 0.493 . . . . 0.0 110.932 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 58.5 m-70 -163.45 61.8 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.202 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.5 t -53.52 137.88 35.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.402 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.548 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 28.8 mm -115.59 149.84 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.343 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.458 ' N ' HG23 ' A' ' 57' ' ' ILE . 47.7 t -141.34 53.83 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.132 0.491 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -155.06 -67.3 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.72 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.505 ' N ' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -177.23 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.681 0.276 . . . . 0.0 111.351 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -172.5 18.54 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.548 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 39.4 p90 -59.89 -33.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.431 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.76 -58.21 5.45 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.337 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.422 ' O ' ' CD1' ' A' ' 65' ' ' TYR . 81.2 p 51.41 75.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD1' ' O ' ' A' ' 64' ' ' SER . 23.1 m-85 -143.1 29.72 1.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.214 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.442 ' O ' ' N ' ' A' ' 70' ' ' THR . 47.7 t -58.73 -62.08 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.701 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.403 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 86.6 m -55.52 -31.7 62.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.83 0.347 . . . . 0.0 110.949 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.458 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 18.7 t-160 -77.13 -5.52 49.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.066 178.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.467 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 89.3 mt-10 -160.47 50.58 0.28 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 66' ' ' VAL . 98.9 m -86.48 -9.05 57.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -45.28 -24.66 0.3 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.718 0.294 . . . . 0.0 111.744 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 71' ' ' LYS . 4.3 m170 -171.91 99.92 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.109 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.521 ' O ' ' HB2' ' A' ' 13' ' ' MET . 2.1 p90 -113.97 166.55 11.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.502 . . . . 0.0 111.761 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.494 HG22 ' O ' ' A' ' 85' ' ' LEU . 8.2 tt -158.79 123.71 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.001 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.415 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 13.8 m-30 -111.18 139.31 46.67 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.486 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 16.8 p90 -170.47 132.37 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.025 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.602 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 2.5 p90 -126.43 154.31 43.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.737 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 81.5 mt -115.58 103.13 10.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.519 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.26 -86.67 0.4 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.485 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.479 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -124.63 -11.79 7.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.7 t -95.59 120.15 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.718 0.294 . . . . 0.0 110.778 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.602 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -98.48 129.0 45.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 111.758 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.486 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 69.3 mt -109.34 131.39 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.014 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.415 ' HG ' ' CD1' ' A' ' 75' ' ' TYR . 6.4 mp -127.88 107.79 10.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.646 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.494 ' O ' HG22 ' A' ' 74' ' ' ILE . 67.0 tp -106.91 133.81 51.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.405 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.505 ' HB3' ' HA ' ' A' ' 73' ' ' PHE . 10.6 p90 -169.72 157.09 6.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.087 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.64 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -144.99 157.67 44.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.281 0.563 . . . . 0.0 111.795 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.467 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 41.9 t -87.61 179.49 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.2 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.332 -1.26 . . . . 0.0 112.451 179.692 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.4 mtp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.81 0.338 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.3 t -146.84 -175.96 5.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.783 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -163.92 71.86 0.24 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -103.18 -37.83 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.633 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -90.92 46.57 1.33 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.811 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.44 93.33 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.477 ' HB ' ' CZ ' ' A' ' 77' ' ' TYR . 43.7 t -131.72 149.18 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.134 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.473 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 2.8 mp -108.0 138.05 36.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.106 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.48 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 27.5 mtpp -96.92 29.4 3.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.11 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.48 ' HB3' ' O ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER 88.97 85.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.576 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.454 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -98.81 165.75 11.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.184 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.1 t70 -148.93 21.57 0.99 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.552 ' O ' ' HG2' ' A' ' 13' ' ' MET . 47.3 ttm -94.54 42.27 1.09 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 16' ' ' ASP . 50.0 m 68.19 111.94 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.853 0.359 . . . . 0.0 110.321 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.419 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 8.6 mp0 -33.69 -34.62 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.194 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 14' ' ' SER . 7.5 t70 -55.82 -45.22 78.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.863 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.461 ' HG3' ' HG2' ' A' ' 13' ' ' MET . 23.4 mmt -69.96 -22.14 63.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.757 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.472 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 0.7 OUTLIER -68.78 -39.57 80.14 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.62 -38.61 54.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.823 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -72.8 -54.41 8.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.433 . . . . 0.0 110.535 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.23 -49.86 70.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.284 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 77.8 t -57.86 -54.66 28.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.199 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.549 ' O ' HG23 ' A' ' 26' ' ' THR . 63.2 m-20 -66.78 -26.13 66.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.805 0.336 . . . . 0.0 110.746 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 49.3 t -73.05 -29.09 62.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.67 -31.83 52.79 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.346 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.549 HG23 ' O ' ' A' ' 23' ' ' ASP . 3.9 t -78.48 -48.73 14.75 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.155 -0.684 . . . . 0.0 109.155 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' N ' ' CG2' ' A' ' 26' ' ' THR . 11.6 mm100 -64.42 -25.6 68.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.125 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.96 -44.63 47.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.977 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -24.07 55.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.22 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 26' ' ' THR . 96.5 mt-10 -77.51 -55.84 5.04 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.984 0.421 . . . . 0.0 110.021 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.81 -25.17 67.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.762 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -141.18 135.05 30.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -102.28 26.1 8.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.319 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.417 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 5.6 mm -98.55 177.14 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -115.22 0.22 13.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.662 0.268 . . . . 0.0 110.935 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.464 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 8.0 mtpm? -111.27 -47.69 3.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.272 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -59.71 -26.21 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 39.8 mm -63.85 -58.97 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.341 179.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -19.84 64.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.0 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.408 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -78.9 -43.12 25.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.98 -28.26 66.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.003 0.43 . . . . 0.0 110.015 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.426 HD12 HG21 ' A' ' 42' ' ' ILE . 74.4 mt -82.59 -46.59 19.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.485 178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -67.88 -30.77 70.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.169 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 45.3 mmtm -79.03 -40.26 31.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.78 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.5 -42.38 87.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.031 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -82.0 -45.43 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.763 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -25.67 65.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.453 ' NZ ' ' HB2' ' A' ' 48' ' ' LYS . 4.7 ttmp? -71.06 -21.27 62.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.615 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -125.13 -4.44 7.42 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.422 ' CZ ' ' HE3' ' A' ' 17' ' ' MET . 2.8 m-85 -130.19 4.98 4.84 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.89 156.78 0.1 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 111.146 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.425 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.7 Cg_endo -60.49 174.66 1.46 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.545 2.163 . . . . 0.0 112.089 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.425 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 9.0 t -122.26 125.21 45.54 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.132 0.573 . . . . 0.0 110.884 0.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.523 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.0 m95 -117.27 -171.61 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.463 ' CD2' HD13 ' A' ' 57' ' ' ILE . 73.4 t60 -174.31 72.64 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.998 0.427 . . . . 0.0 110.878 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.9 t -59.43 128.85 39.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.836 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.506 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 33.3 mm -98.5 147.22 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.439 ' N ' HG23 ' A' ' 57' ' ' ILE . 49.1 t -127.98 65.16 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.821 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.11 -97.15 0.11 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -123.6 -83.75 0.65 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.656 0.265 . . . . 0.0 110.922 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.456 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -152.34 10.96 0.52 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.818 -179.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.506 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 23.2 p90 -49.24 -24.1 1.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -177.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.85 44.64 1.33 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.456 -0.878 . . . . 0.0 113.068 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.6 m -93.59 62.13 3.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -109.75 29.79 7.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.164 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.445 ' CB ' ' HB2' ' A' ' 86' ' ' PHE . 47.6 t -118.37 -22.59 4.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.549 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.9 m -48.45 -27.69 2.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -45.7 -28.25 0.98 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.447 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.5 mm-40 -108.55 -67.51 0.97 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.219 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.447 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 11.4 m 80.47 0.6 1.92 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.901 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.487 ' HG3' ' CE1' ' A' ' 72' ' ' HIS . 21.9 tptm -47.1 -28.52 1.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.196 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.487 ' CE1' ' HG3' ' A' ' 71' ' ' LYS . 67.0 m80 -157.05 93.94 1.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.395 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.568 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -120.98 152.28 38.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.235 -179.383 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.525 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 7.9 tt -152.42 120.5 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.217 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -107.68 139.26 42.5 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.921 0.391 . . . . 0.0 111.376 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.488 ' CZ ' HG22 ' A' ' 83' ' ' ILE . 1.5 p90 -170.28 122.22 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.489 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.562 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 4.8 p90 -104.99 144.7 31.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.062 0.458 . . . . 0.0 111.526 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 71.3 mt -111.98 110.98 21.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.422 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -76.58 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.422 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -149.02 25.7 0.91 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 0.0 111.035 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.26 100.87 3.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.031 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.562 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -69.76 127.27 32.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.607 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.488 HG22 ' CZ ' ' A' ' 76' ' ' PHE . 62.5 mt -104.04 138.53 28.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.553 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 11.0 mp -128.09 103.66 7.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.019 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.525 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 59.1 tp -108.31 113.31 26.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.49 ' CD1' ' HB2' ' A' ' 73' ' ' PHE . 9.0 m-85 -127.14 -179.19 4.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 111.565 -178.459 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.523 ' HB2' ' CE3' ' A' ' 54' ' ' TRP . 1.5 tmtp? -151.87 98.47 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.069 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 48.0 t -73.17 81.05 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.829 0.347 . . . . 0.0 110.838 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.463 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.918 0.39 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.1 t -103.67 -175.82 2.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.008 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -158.26 82.7 0.84 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -147.8 176.46 10.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -149.24 57.29 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.129 0.49 . . . . 0.0 110.643 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.97 103.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.581 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 26.6 t -153.76 163.91 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.243 -179.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 58.8 mt -114.69 115.31 49.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.343 179.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -70.07 -41.26 74.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.272 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.66 74.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 0.0 110.679 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.472 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -79.18 142.63 36.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.482 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 8.8 t70 -146.78 23.55 1.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.68 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.492 ' HE1' ' O ' ' A' ' 72' ' ' HIS . 27.4 ttm -107.9 47.58 0.89 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.076 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.465 ' HB3' ' O ' ' A' ' 13' ' ' MET . 33.2 t 74.37 114.82 0.06 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.617 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.459 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 16.6 pt-20 -32.56 -35.67 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.666 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 14' ' ' SER . 65.9 t0 -54.55 -37.57 65.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.858 0.361 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.431 ' O ' ' CB ' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -74.71 -19.82 60.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.467 ' OE1' ' N ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -70.76 -45.06 65.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.826 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -78.75 -32.95 46.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.582 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.436 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.9 t70 -72.09 -46.62 56.05 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.431 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -61.08 -41.61 96.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.636 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.465 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 76.6 t -57.69 -58.46 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-O 120.716 0.293 . . . . 0.0 110.587 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 55.9 m-20 -66.13 -30.39 70.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.187 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.416 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 42.1 t -68.67 -33.9 74.78 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.92 -25.38 37.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.678 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.6 m -74.86 -49.86 19.02 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.782 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 23' ' ' ASP . 9.1 mp0 -73.53 -24.38 60.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.84 -45.73 70.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.905 0.383 . . . . 0.0 110.255 179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.0 mmt -79.53 -19.7 48.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.784 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -79.3 -46.45 17.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.542 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -81.07 -18.28 47.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.316 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -149.84 167.09 27.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.811 0.339 . . . . 0.0 111.35 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -156.54 45.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.993 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.2 mt -99.65 -7.06 9.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.391 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.9 mt-10 76.44 -56.07 0.57 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.954 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.474 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 7.9 mtpm? -76.76 -53.66 7.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.578 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -55.6 -26.81 45.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.223 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.3 mm -61.27 -52.32 62.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.279 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.11 -26.59 62.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.047 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.577 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -77.45 -42.91 34.24 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.96 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.429 ' CE1' ' OE2' ' A' ' 45' ' ' GLU . 5.1 t80 -68.88 -31.14 69.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.069 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.416 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 97.2 mt -76.62 -50.65 21.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.744 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.577 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 17.9 ptpt -63.63 -35.19 79.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.506 ' C ' ' HD3' ' A' ' 44' ' ' LYS . 0.9 OUTLIER -56.41 -52.57 64.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.623 179.271 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.429 ' OE2' ' CE1' ' A' ' 41' ' ' TYR . 94.3 mt-10 -58.15 -48.68 79.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.675 0.274 . . . . 0.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.436 ' CZ ' ' OD2' ' A' ' 20' ' ' ASP . 8.3 m-85 -64.97 -21.13 66.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.617 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 41.8 m-20 -80.33 -34.36 36.75 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.652 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 7.7 mmpt? -90.13 13.95 13.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.541 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.446 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 6.7 ttpm? -119.43 -6.75 10.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.484 0.183 . . . . 0.0 111.329 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' HE2' ' A' ' 49' ' ' LYS . 51.2 m-85 -148.61 -79.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 111.07 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -177.98 135.77 0.35 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.716 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.31 169.27 22.02 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.425 2.083 . . . . 0.0 112.445 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.9 m -114.32 127.85 56.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.982 0.513 . . . . 0.0 110.844 0.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.455 ' CD1' ' OD1' ' A' ' 47' ' ' ASP . 7.9 m95 -89.02 176.06 7.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.053 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.435 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 73.8 t60 -155.4 103.97 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.952 0.406 . . . . 0.0 110.841 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.1 t -93.83 147.37 23.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.066 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.457 ' CG2' ' CZ ' ' A' ' 62' ' ' PHE . 6.9 mm -117.46 162.41 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.66 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 59.1 t -147.19 87.51 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.052 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.66 -87.5 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.465 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 77.9 mtt-85 -157.99 66.54 0.47 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.946 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.465 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER 49.46 15.67 0.14 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.252 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.457 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 6.3 p90 -59.68 -19.03 46.9 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.521 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -54.4 -51.26 52.67 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.903 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.1 m 49.34 70.18 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.877 0.37 . . . . 0.0 110.583 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.488 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 1.6 t80 -149.65 50.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.149 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.453 HG13 ' HB ' ' A' ' 70' ' ' THR . 39.4 t -119.67 -0.88 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.069 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -107.21 -29.05 9.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.715 0.293 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 93.2 m-70 -49.09 -27.47 3.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.816 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 14.4 pt-20 153.52 49.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.59 0.556 . . . . 0.0 110.9 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.504 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 44.8 m -103.1 -86.79 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.317 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.4 OUTLIER 75.35 -13.86 0.82 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.65 -179.501 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.492 ' O ' ' HE1' ' A' ' 13' ' ' MET . 53.3 m170 -123.29 81.17 1.86 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.479 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 5.7 p90 -114.29 170.95 7.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.716 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.472 HG13 ' CB ' ' A' ' 11' ' ' ALA . 7.5 tt -147.18 108.42 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.579 178.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.429 ' CD1' HD11 ' A' ' 84' ' ' LEU . 7.6 m-30 -76.64 149.87 36.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.487 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.561 ' HB3' ' HB ' ' A' ' 83' ' ' ILE . 3.2 t80 -150.53 135.42 17.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.217 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 51.9 t80 -125.89 127.76 46.52 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.757 0.313 . . . . 0.0 111.459 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.427 HD11 ' N ' ' A' ' 78' ' ' LEU . 0.7 OUTLIER -126.57 109.79 12.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.795 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.41 -88.1 0.01 OUTLIER Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.768 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.508 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -129.61 21.42 5.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 111.021 -179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.415 ' O ' ' CD1' ' A' ' 77' ' ' TYR . 53.8 t -128.16 160.76 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.737 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -130.11 115.04 16.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.785 0.326 . . . . 0.0 111.303 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.561 ' HB ' ' HB3' ' A' ' 76' ' ' PHE . 68.5 mt -95.16 125.01 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.429 HD11 ' CD1' ' A' ' 75' ' ' TYR . 52.0 tp -119.87 107.28 12.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.704 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.449 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 59.6 tp -106.87 150.44 26.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.941 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.488 ' CE2' ' O ' ' A' ' 65' ' ' TYR . 17.9 p90 -174.62 178.27 1.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.07 0.462 . . . . 0.0 111.508 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.445 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 5.8 tmtm? -132.76 88.87 2.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.336 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.503 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 43.3 t -73.15 69.24 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.581 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.59 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttm . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t -90.89 142.11 28.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.03 31.59 4.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.892 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -117.73 -168.65 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -133.98 57.99 1.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -171.11 84.06 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.27 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.7 t -130.79 135.34 60.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.839 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.502 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.9 mp -104.19 96.93 4.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 27.6 mtpp -60.99 -18.58 58.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.435 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 43.7 t30 172.66 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.994 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -156.5 138.59 14.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.008 0.433 . . . . 0.0 111.664 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.433 ' HB3' ' CE1' ' A' ' 73' ' ' PHE . 38.5 t70 -133.91 12.21 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.768 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.603 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 47.8 ttm -90.7 34.34 0.9 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.22 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.47 ' O ' ' N ' ' A' ' 16' ' ' ASP . 38.6 t 68.4 112.02 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.495 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.4 mt-10 -27.58 -39.08 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.563 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 14' ' ' SER . 1.5 m-20 -51.32 -45.64 62.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.355 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.499 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.6 mpt? -70.76 -23.24 62.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.144 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.495 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 63.0 mt-30 -70.8 -37.87 73.31 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -80.52 -34.57 35.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.68 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -74.93 -50.88 15.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.071 0.462 . . . . 0.0 110.404 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.5 65.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.195 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.452 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 96.5 t -58.65 -47.67 88.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.614 0.245 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 36.5 t70 -66.63 -35.19 79.58 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.628 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.0 t -68.12 -35.2 77.75 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -24.9 49.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.725 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -75.97 -52.89 9.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.875 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 23.5 pt20 -66.95 -26.15 66.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.969 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -56.44 12.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.508 179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.409 ' N ' HD13 ' A' ' 38' ' ' ILE . 22.3 ptp -69.28 -18.6 63.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -82.47 -47.82 11.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.245 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -72.86 -27.96 62.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.47 ' CD2' ' OD2' ' A' ' 37' ' ' ASP . 13.1 m-85 -119.24 -170.88 2.01 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.453 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.4 ' ND2' ' O ' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -147.67 27.94 0.97 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.795 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.5 ' HB ' ' OD1' ' A' ' 37' ' ' ASP . 7.1 mt -121.21 170.7 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -114.48 23.79 12.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.779 0.323 . . . . 0.0 110.977 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -124.68 -49.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.578 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.5 ' OD1' ' HB ' ' A' ' 34' ' ' ILE . 9.4 p-10 -64.09 -27.37 69.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.419 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 34.3 mm -61.35 -57.04 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.649 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.62 -28.83 61.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.28 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -76.96 -35.14 57.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -69.38 -30.35 68.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.78 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.555 HD12 ' N ' ' A' ' 42' ' ' ILE . 2.1 mp -84.28 -43.51 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -66.29 -31.95 73.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.939 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 73.2 mmtt -83.45 -39.45 20.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.92 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -54.04 -47.29 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.961 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.462 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 56.1 m-85 -80.05 -44.41 20.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.221 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -67.0 -9.81 42.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.75 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.65 -27.62 34.01 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.97 41.44 0.83 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.431 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 9.1 m-85 -132.78 -86.63 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.567 0.223 . . . . 0.0 111.022 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.59 104.78 0.16 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.515 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 31.3 Cg_exo -57.46 160.28 14.32 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.195 1.93 . . . . 0.0 111.996 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.8 m -112.38 142.52 44.82 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.303 0.641 . . . . 0.0 110.621 -0.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.436 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 19.5 m95 -111.08 138.2 47.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.839 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.481 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 52.8 m170 -122.03 98.15 5.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.065 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 54.0 t -82.04 142.32 32.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.568 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.56 HG13 ' HA2' ' A' ' 63' ' ' GLY . 16.5 mm -117.75 142.92 29.85 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-O 120.842 0.354 . . . . 0.0 111.773 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.482 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 12.3 p -127.71 94.57 2.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.394 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 168.19 -94.43 0.11 Allowed Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.947 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -125.22 -85.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.574 0.225 . . . . 0.0 111.604 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.512 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -146.41 13.81 1.24 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.525 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 21.2 p90 -70.94 52.03 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 111.054 -177.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.56 ' HA2' HG13 ' A' ' 57' ' ' ILE . . . -78.69 -62.0 2.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.419 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' CG ' ' A' ' 65' ' ' TYR . 21.3 m 79.58 116.58 0.06 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.565 ' CG ' ' O ' ' A' ' 64' ' ' SER . 36.1 p90 53.39 64.26 1.92 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.738 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.469 ' HA ' ' CG ' ' A' ' 86' ' ' PHE . 51.8 t -94.4 -24.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.626 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.47 ' CG2' ' HD2' ' A' ' 71' ' ' LYS . 87.2 m -134.82 -32.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.671 0.272 . . . . 0.0 111.555 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.72 -5.93 18.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.535 ' HG2' ' N ' ' A' ' 70' ' ' THR . 13.8 pm0 -91.01 -50.86 5.63 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.555 ' O ' ' CB ' ' A' ' 71' ' ' LYS . 4.5 t -134.4 -44.67 0.76 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' A' ' 70' ' ' THR . 14.2 mmmm 108.69 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.394 1.059 . . . . 0.0 110.017 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 94.3 m-70 -128.54 79.21 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.581 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.603 ' O ' ' HB2' ' A' ' 13' ' ' MET . 11.0 p90 -118.7 171.64 8.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.429 ' CG2' ' CE ' ' A' ' 13' ' ' MET . 12.4 tt -168.07 111.0 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.094 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.433 ' CZ ' HD11 ' A' ' 84' ' ' LEU . 8.7 m-85 -97.22 154.58 17.3 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.035 0.445 . . . . 0.0 111.576 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.501 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 15.0 p90 -170.37 123.67 0.69 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.724 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -88.18 125.77 34.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.592 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 86.6 mt -123.17 132.87 54.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.218 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.99 -100.0 0.06 OUTLIER Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.792 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.527 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.49 23.84 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.712 0.291 . . . . 0.0 111.014 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 46.9 t -140.64 137.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -90.9 128.66 36.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.077 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.501 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 73.6 mt -118.85 137.44 52.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.516 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.482 ' HG ' ' CG1' ' A' ' 57' ' ' ILE . 0.7 OUTLIER -135.09 113.66 11.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.103 0.478 . . . . 0.0 111.47 179.622 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.462 ' CD2' ' CD2' ' A' ' 46' ' ' PHE . 45.8 tp -98.99 141.05 32.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.67 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.481 ' CZ ' ' HB2' ' A' ' 55' ' ' HIS . 8.0 p90 -156.44 139.86 15.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.448 0.642 . . . . 0.0 111.616 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.569 ' HD3' ' N ' ' A' ' 88' ' ' SER . 1.6 tmtp? -94.32 154.2 17.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.435 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.569 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 8.6 m -127.95 148.44 50.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.845 0.355 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.489 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.875 0.369 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.4 m -98.8 109.58 22.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.9 52.54 2.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -152.76 146.33 25.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.953 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -168.63 30.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . 61.69 132.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.36 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.433 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.498 HG12 ' HB3' ' A' ' 76' ' ' PHE . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.42 ' HB2' ' OE1' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.556 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.556 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.449 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.424 ' CD2' HD23 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.441 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.412 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.519 HG21 ' CE1' ' A' ' 62' ' ' PHE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.42 ' N ' HG22 ' A' ' 57' ' ' ILE . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.442 ' HA ' ' CB ' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.542 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.519 ' CE1' HG21 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.486 ' CG2' ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.444 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.489 ' CD2' ' HG3' ' A' ' 71' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.475 ' HB ' ' HB2' ' A' ' 13' ' ' MET . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.498 ' HB3' HG12 ' A' ' 8' ' ' ILE . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.489 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.484 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.486 ' CE2' ' CG2' ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.488 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.815 0.34 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t 61.74 152.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.783 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -176.74 82.22 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 21.5 tpp180 -105.3 -18.63 14.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.144 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.496 ' N ' ' HD3' ' A' ' 5' ' ' LYS . 3.3 mppt? 63.67 86.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.979 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.37 124.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.229 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -144.46 81.38 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.138 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.536 HG12 ' HB3' ' A' ' 76' ' ' PHE . 61.1 mt -60.75 116.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.969 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -71.95 -44.39 63.66 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.603 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 43.9 t30 -153.71 116.98 4.58 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.902 0.382 . . . . 0.0 110.941 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.73 84.0 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.224 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 59.5 t0 -81.1 -5.21 57.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.971 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.446 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.7 tpp -92.99 162.64 13.97 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.58 0.229 . . . . 0.0 110.444 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.418 ' N ' ' HG3' ' A' ' 13' ' ' MET . 62.9 m -40.07 -74.56 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.968 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.474 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 39.6 tt0 177.71 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.527 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -56.85 -33.08 66.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.099 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.446 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.59 -26.77 58.15 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.672 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.474 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 62.8 mt-30 -66.33 -46.07 78.09 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -79.92 -32.55 40.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.94 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.4 t0 -72.67 -50.06 27.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.44 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -58.82 -48.83 79.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.081 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.434 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 90.9 t -55.23 -53.12 38.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.917 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -71.84 -24.5 61.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.834 0.35 . . . . 0.0 110.653 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 39.1 t -72.87 -32.8 65.65 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.07 -27.55 39.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.894 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.7 m -78.2 -45.83 22.03 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.536 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.8 mt-30 -71.98 -24.92 61.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.355 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.0 -41.78 50.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.177 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -74.93 -29.82 61.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.688 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.536 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.4 pt-20 -82.38 -43.04 17.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.982 0.42 . . . . 0.0 110.135 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' O ' ' CD1' ' A' ' 32' ' ' TYR . 62.8 tttp -76.31 -21.35 56.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.743 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.4 ' CD1' ' O ' ' A' ' 31' ' ' LYS . 54.7 m-85 -152.51 161.1 43.05 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.979 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -144.5 18.57 1.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.464 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.6 mm -75.77 -13.78 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.379 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 87.2 mt-10 74.94 -54.02 0.67 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.823 0.344 . . . . 0.0 110.772 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -69.75 -57.96 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.51 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.86 -27.22 17.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.305 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.436 ' O ' HG13 ' A' ' 42' ' ' ILE . 49.3 mm -61.31 -54.22 38.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.438 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.14 -27.12 63.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.503 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -80.73 -38.78 28.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.762 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -70.42 -27.6 64.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.358 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 38' ' ' ILE . 86.9 mt -79.55 -47.69 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.553 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -65.29 -38.45 90.26 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.4 tptm -57.02 -57.29 13.2 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.126 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -55.13 -51.24 67.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.225 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.426 ' CE1' ' OD2' ' A' ' 20' ' ' ASP . 39.8 m-85 -62.67 -25.38 68.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.713 0.292 . . . . 0.0 111.115 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -86.45 -25.99 24.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.158 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -89.9 -17.53 27.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.429 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -101.84 -61.14 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.701 0.286 . . . . 0.0 111.353 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -91.71 14.7 14.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.627 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.407 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 75.1 m-20 59.79 157.14 0.1 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.679 0.276 . . . . 0.0 110.94 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 15.2 Cg_endo -57.3 172.63 0.86 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.533 2.155 . . . . 0.0 112.066 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.5 t -122.82 103.41 8.62 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.077 0.551 . . . . 0.0 110.819 0.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.447 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.5 m95 -102.12 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.471 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 78.1 t60 178.17 75.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.238 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.2 t -64.21 148.25 50.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.396 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.478 ' O ' ' HA ' ' A' ' 83' ' ' ILE . 19.5 mm -114.68 146.18 19.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.604 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.438 ' N ' HG21 ' A' ' 57' ' ' ILE . 48.7 t -133.23 77.22 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.769 179.498 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.76 -81.2 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.521 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 55.9 mtp85 -142.72 -80.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.748 0.309 . . . . 0.0 111.288 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.473 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.3 14.43 0.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.761 -179.618 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.44 ' CZ ' HG21 ' A' ' 57' ' ' ILE . 5.5 p90 -51.66 -25.67 7.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.341 . . . . 0.0 111.263 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.34 51.96 0.84 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.023 -0.608 . . . . 0.0 111.728 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.0 p -85.78 60.48 6.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.057 0.456 . . . . 0.0 111.178 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.437 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 13.8 m-85 -89.47 30.7 0.98 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.685 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.46 ' CG1' ' CD2' ' A' ' 73' ' ' PHE . 66.3 t -46.84 -77.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.9 m -53.08 -30.55 36.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.522 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -56.78 -20.98 25.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.866 0.365 . . . . 0.0 110.258 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.596 ' HG3' ' HB2' ' A' ' 88' ' ' SER . 0.3 OUTLIER -82.39 -73.62 0.39 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.357 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.534 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 1.5 t -175.61 -86.64 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.406 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.534 ' H ' ' CG2' ' A' ' 70' ' ' THR . 13.9 tptt -163.47 26.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.992 0.425 . . . . 0.0 110.373 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -122.88 75.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 9.3 p90 -119.23 -176.25 3.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.192 0.52 . . . . 0.0 111.858 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.434 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt 177.68 111.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.421 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.603 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 9.3 p90 -123.99 147.93 47.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.289 0.566 . . . . 0.0 111.986 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.536 ' HB3' HG12 ' A' ' 8' ' ' ILE . 2.0 p90 -140.37 170.14 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.846 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -121.21 137.72 54.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.726 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 84.3 mt -131.36 130.88 43.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.116 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.7 -92.09 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.806 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -138.46 33.82 2.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.996 0.426 . . . . 0.0 110.94 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 87.8 t -138.38 150.59 24.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.556 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.92 118.68 36.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.123 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.478 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 2.5 mp -105.07 132.97 50.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.452 HD23 ' HB ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -137.61 124.51 21.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.104 0.478 . . . . 0.0 111.487 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 33.2 tp -119.74 137.47 53.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.876 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.552 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 2.8 p90 -137.68 152.65 49.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.181 0.515 . . . . 0.0 111.965 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.521 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 6.4 tmtm? -124.94 127.93 47.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.155 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.596 ' HB2' ' HG3' ' A' ' 69' ' ' GLU . 29.0 t -96.22 151.3 19.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.623 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.493 ' N ' HG23 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.554 179.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.889 0.376 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.8 p -179.17 -175.23 0.36 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.808 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -173.47 82.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.791 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -152.31 -179.31 7.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.934 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.483 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -98.08 33.13 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -171.62 93.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.682 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 44.3 t -134.04 105.34 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.43 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.463 ' CD1' ' CG ' ' A' ' 18' ' ' GLN . 67.6 mt -82.58 113.94 22.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.955 0.407 . . . . 0.0 110.585 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -78.8 -34.3 45.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.955 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -169.88 110.73 0.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.421 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -125.3 137.32 54.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.974 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -140.88 2.03 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.504 ' O ' ' HG2' ' A' ' 13' ' ' MET . 50.2 ttp -94.19 58.87 2.56 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.781 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.9 t 64.18 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.02 0.438 . . . . 0.0 111.283 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.523 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -35.08 -34.51 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.853 179.615 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -50.9 -39.19 53.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.853 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -68.77 -25.31 64.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.245 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.523 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 2.8 mp0 -68.57 -42.91 77.62 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.068 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -79.05 -32.07 44.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.393 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -77.11 -50.19 13.59 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.896 0.379 . . . . 0.0 110.636 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.78 80.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.874 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.421 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 98.8 t -63.07 -41.05 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.726 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -68.11 -39.68 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 81.1 m -67.71 -32.78 73.66 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.29 -25.55 46.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.469 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 99.0 m -74.97 -55.24 5.97 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -65.36 -26.63 68.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.212 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -67.54 -46.55 72.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.613 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.505 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 1.6 tpt -70.06 -27.02 64.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.749 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -83.31 -43.22 16.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.027 0.442 . . . . 0.0 110.125 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -77.86 -22.54 49.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.919 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -133.79 150.05 51.43 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.741 0.305 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -116.37 29.83 7.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.022 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.401 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 4.9 mt -123.55 176.35 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -109.18 14.73 23.7 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.775 0.321 . . . . 0.0 110.786 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.529 ' HA ' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -113.99 -58.9 2.09 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.288 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -53.52 -25.76 18.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.903 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.417 HD12 HG21 ' A' ' 38' ' ' ILE . 40.4 mm -64.0 -59.94 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.465 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.442 ' O ' ' HG2' ' A' ' 43' ' ' LYS . . . -58.05 -29.91 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.97 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.483 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -71.69 -42.78 67.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.376 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.411 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 5.5 t80 -66.78 -27.8 67.88 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.92 0.391 . . . . 0.0 110.256 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.422 HD11 HG22 ' A' ' 42' ' ' ILE . 75.6 mt -79.06 -50.39 18.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.184 179.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.483 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.2 pttm -71.23 -27.78 63.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.407 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 55.9 mtpt -71.26 -48.12 52.96 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.648 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -61.39 -37.56 83.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.734 0.302 . . . . 0.0 110.818 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.462 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 4.7 m-85 -83.29 -19.54 36.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.755 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.4 -36.72 16.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.72 0.295 . . . . 0.0 111.395 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.449 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 4.0 mptp? -90.27 29.21 1.28 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.363 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -145.86 -44.37 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -104.79 5.79 33.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.45 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 m120 61.61 154.0 0.11 Allowed Pre-proline 0 C--N 1.333 -0.141 0 CA-C-O 120.766 0.317 . . . . 0.0 110.886 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.01 174.77 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.579 2.186 . . . . 0.0 112.173 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -126.84 97.22 4.9 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 123.118 0.567 . . . . 0.0 110.455 -0.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.601 ' HB2' ' O ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -150.9 -179.08 6.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.889 -179.733 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -179.51 -179.63 0.54 Allowed 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 120.935 0.397 . . . . 0.0 111.043 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 31.9 p -116.91 153.33 32.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.357 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 83' ' ' ILE . 19.4 mm -94.38 147.63 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.294 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 11.4 p -122.19 72.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.534 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.52 -78.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.376 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -149.79 -82.09 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.7 0.286 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.468 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 13.02 0.35 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.775 -179.933 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.456 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 4.1 p90 -55.97 -20.29 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -129.14 50.04 0.9 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.732 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.5 m -50.11 -87.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.79 -0.241 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 58.38 61.46 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.004 0.431 . . . . 0.0 110.72 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.461 ' O ' ' HB ' ' A' ' 70' ' ' THR . 43.8 t -116.64 -0.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.838 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -111.37 -28.1 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.777 0.322 . . . . 0.0 111.172 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.585 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 90.4 m-70 -48.37 -27.73 2.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.178 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.585 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 16.6 pt-20 155.22 45.85 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.819 0.447 . . . . 0.0 110.735 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 22.9 m -92.31 -85.96 0.25 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.516 -179.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 70' ' ' THR . 31.1 mmmt 76.12 -12.32 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.074 -179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 19.9 m80 -132.89 81.45 1.94 Allowed 'General case' 0 C--O 1.23 0.076 0 CA-C-O 120.962 0.411 . . . . 0.0 110.25 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 17.7 p90 -115.47 -177.08 3.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.651 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.474 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 9.0 tt -168.55 123.24 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.05 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.484 ' CD1' ' CD2' ' A' ' 84' ' ' LEU . 61.4 m-85 -101.76 137.27 40.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 1.3 p90 -159.03 117.54 2.92 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.085 0.469 . . . . 0.0 111.281 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -84.53 136.78 33.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.924 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.0 mt -136.58 123.68 21.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.922 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 54.05 -106.61 0.5 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.541 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.6 pp0? -125.46 33.72 5.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 111.352 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 89.0 t -155.46 124.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.601 179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.64 131.61 34.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.9 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.587 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 63.6 mt -110.02 138.72 36.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.532 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.484 ' CD2' ' CD1' ' A' ' 75' ' ' TYR . 2.8 tm? -135.75 115.59 13.06 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.927 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.572 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 56.0 tp -96.91 136.84 36.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.605 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.601 ' O ' ' HB2' ' A' ' 54' ' ' TRP . 23.6 p90 -142.3 123.64 14.77 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.675 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.528 ' HA ' ' CB ' ' A' ' 54' ' ' TRP . 1.6 tmtp? -84.96 69.3 10.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.562 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 47.6 t -76.75 63.66 2.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.539 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.3 mtp . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 120.706 0.288 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.2 m -150.0 42.89 0.87 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -85.4 57.64 4.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.709 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 51.0 mmt-85 -123.61 -168.77 1.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -174.69 55.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.512 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.52 83.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.517 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 57.9 t -123.68 134.37 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.113 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.511 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 2.0 mp -112.35 101.05 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.177 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.473 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 33.3 mmtp -54.74 -23.14 16.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.87 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 45.1 t30 177.44 119.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.691 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.94 95.62 8.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.852 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.432 ' HB2' ' CE1' ' A' ' 73' ' ' PHE . 65.7 t0 -82.08 -33.31 29.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.153 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.51 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 50.9 tpp -78.01 162.22 26.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.713 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' A' ' 13' ' ' MET . 43.0 t -39.67 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.126 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -178.5 -29.68 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.18 -34.58 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.739 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.51 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 24.0 mmt -74.9 -24.82 58.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.666 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.454 ' HA ' HD13 ' A' ' 74' ' ' ILE . 3.2 mp0 -67.5 -45.14 76.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -81.04 -31.44 34.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.241 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 46' ' ' PHE . 10.2 t0 -77.03 -50.19 13.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.342 . . . . 0.0 110.681 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.404 ' HB2' ' CZ ' ' A' ' 76' ' ' PHE . . . -65.57 -48.09 73.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.318 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.448 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 88.7 t -62.44 -46.16 97.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.427 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 66.3 t0 -72.0 -34.87 69.22 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 121.138 -0.225 . . . . 0.0 110.702 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.9 t -68.9 -33.68 74.17 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.21 -27.08 53.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.523 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 92.7 m -74.96 -53.53 8.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.004 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 24.4 pt20 -68.32 -23.28 64.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.93 -47.82 56.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.915 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -72.21 -27.14 62.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.16 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -79.44 -46.25 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.486 ' HG3' ' CE1' ' A' ' 32' ' ' TYR . 16.9 tppt? -82.37 -24.19 34.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.486 ' CE1' ' HG3' ' A' ' 31' ' ' LYS . 7.6 m-85 -134.77 156.24 49.2 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.844 0.354 . . . . 0.0 110.621 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -143.86 23.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.115 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.469 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.9 mm -78.07 -16.55 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.59 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.469 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 86.4 mt-10 76.71 -54.12 0.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -76.51 -50.32 14.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.357 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.3 t0 -56.14 -29.84 61.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.945 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.4 mm -58.01 -53.05 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.351 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.25 -24.16 67.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.947 179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.14 -38.09 27.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -70.82 -24.42 62.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.536 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.402 HD12 HG21 ' A' ' 42' ' ' ILE . 79.6 mt -84.91 -46.27 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.412 ' O ' ' HD3' ' A' ' 43' ' ' LYS . 5.3 tmtm? -64.31 -37.71 88.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.686 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.484 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 12.2 tppt? -70.71 -56.49 6.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.436 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -49.44 -40.17 35.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.512 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.484 ' CE2' ' CD2' ' A' ' 85' ' ' LEU . 19.2 m-85 -68.37 -51.3 45.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.23 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -68.62 -9.82 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.455 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -59.67 -28.32 67.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.502 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -164.07 32.14 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.45 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 3.4 m-85 -125.85 10.65 7.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.621 0.248 . . . . 0.0 111.196 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 62.99 134.64 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.785 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.413 ' HB2' ' HB ' ' A' ' 53' ' ' THR . 54.8 Cg_endo -70.11 166.89 26.53 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.329 2.019 . . . . 0.0 112.099 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.413 ' HB ' ' HB2' ' A' ' 52' ' ' PRO . 8.8 t -130.75 122.35 27.09 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.234 0.614 . . . . 0.0 110.638 -0.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 54' ' ' TRP . 6.1 m95 -100.12 160.3 14.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.256 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.435 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 89.7 m-70 -131.58 62.38 1.63 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.4 t -55.53 106.95 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.834 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.506 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 25.1 mm -82.29 153.93 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.819 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.425 ' N ' HG23 ' A' ' 57' ' ' ILE . 60.6 t -141.15 68.07 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.93 0.395 . . . . 0.0 110.739 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -174.33 -76.93 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.574 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.9 mtp85 -149.84 -77.91 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.725 0.298 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.483 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -154.96 14.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.608 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.506 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 28.3 p90 -56.98 -16.31 6.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.13 51.58 0.85 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.507 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.497 ' O ' ' CZ ' ' A' ' 86' ' ' PHE . 45.9 t -44.7 -76.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.316 . . . . 0.0 111.631 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 42.59 31.57 0.3 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.489 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.515 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 45.2 t -97.53 -2.84 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.8 m -114.01 -27.41 7.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.822 0.344 . . . . 0.0 111.09 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.577 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 25.5 t-80 -48.28 -27.86 2.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 15.5 pt-20 157.13 44.75 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.422 0.452 . . . . 0.0 111.396 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 73.8 m -86.77 -81.89 0.22 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.333 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 70' ' ' THR . 46.7 mmtm 75.91 -3.73 2.51 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.649 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.439 ' NE2' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -156.48 92.87 1.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.188 0.518 . . . . 0.0 110.716 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.477 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 8.3 p90 -122.62 -170.86 2.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.135 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.495 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 5.5 tt -162.42 110.94 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.567 178.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -99.51 140.12 34.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.457 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.418 ' CZ ' HG23 ' A' ' 83' ' ' ILE . 2.1 p90 -170.17 127.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.101 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.52 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 8.3 p90 -114.47 145.98 41.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.212 0.53 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 81.7 mt -115.58 117.59 30.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.495 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -77.31 0.2 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.413 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -149.56 24.93 0.87 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.1 t -134.14 118.5 28.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.873 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.52 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -92.04 122.78 34.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 112.063 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.472 ' CD1' ' N ' ' A' ' 83' ' ' ILE . 2.3 mp -100.47 133.29 44.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.187 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.434 ' CD1' ' N ' ' A' ' 84' ' ' LEU . 5.4 mp -120.1 97.99 5.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 111.569 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.495 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 49.8 tp -98.69 134.62 41.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.692 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.497 ' CZ ' ' O ' ' A' ' 64' ' ' SER . 7.0 p90 -171.89 163.96 6.32 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.626 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.439 ' HB3' ' NE2' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -113.77 81.21 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.609 179.109 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.601 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 89.3 p -69.02 67.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.843 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.34 -1.256 . . . . 0.0 112.52 179.889 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.875 0.369 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.4 m -98.8 109.58 22.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.9 52.54 2.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -152.76 146.33 25.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.953 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -168.63 30.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . 61.69 132.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.36 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.433 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.498 HG12 ' HB3' ' A' ' 76' ' ' PHE . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.41 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.42 ' HB2' ' OE1' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.556 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.498 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.556 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.45 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.472 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.449 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.449 ' O ' ' HB3' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HB3' ' O ' ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.424 ' CD2' HD23 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.441 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.412 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.519 HG21 ' CE1' ' A' ' 62' ' ' PHE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.42 ' N ' HG22 ' A' ' 57' ' ' ILE . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.442 ' HA ' ' CB ' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.542 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.519 ' CE1' HG21 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.486 ' CG2' ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.444 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.489 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.489 ' CD2' ' HG3' ' A' ' 71' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.483 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.475 ' HB ' ' HB2' ' A' ' 13' ' ' MET . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.498 ' HB3' HG12 ' A' ' 8' ' ' ILE . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.489 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.412 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.489 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.484 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.45 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.46 ' HB3' ' CG2' ' A' ' 74' ' ' ILE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.486 ' CE2' ' CG2' ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.488 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtm . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.977 0.418 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.4 p -67.53 132.48 47.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.006 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 61.34 32.89 19.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.015 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -73.25 -73.12 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.954 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.473 ' O ' ' HG2' ' A' ' 5' ' ' LYS . 37.9 ttpt -164.9 31.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.614 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 179.35 97.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.09 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.2 t -135.14 90.74 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.474 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -80.88 91.09 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.443 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 66.8 mttm -58.79 -20.09 46.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.541 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.45 ' O ' ' HB2' ' A' ' 75' ' ' TYR . 19.9 t-20 173.47 129.66 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.675 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.404 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -146.62 128.74 15.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -131.73 2.91 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.494 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 55.8 ttp -96.47 62.57 2.05 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.934 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 t 64.56 110.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.44 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.497 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.0 mt-10 -40.45 -32.77 0.21 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.246 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -53.94 -35.07 61.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 26.2 mmt -70.91 -24.42 62.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.497 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 3.5 mp0 -71.04 -41.11 71.24 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -77.8 -33.41 52.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.751 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -76.3 -52.52 9.81 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 120.971 0.415 . . . . 0.0 110.668 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.85 -49.94 75.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.446 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 94.4 t -60.37 -51.37 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.46 -29.28 69.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.74 0.305 . . . . 0.0 110.453 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.4 t -71.66 -32.3 67.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.44 -23.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.026 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.0 m -80.56 -44.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -74.45 -28.08 60.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.252 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.13 -50.18 20.54 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.4 tpt -68.46 -25.96 65.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.616 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -80.64 -47.22 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.065 0.459 . . . . 0.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -73.88 -25.03 59.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.678 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -144.28 152.27 40.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.818 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -136.93 46.22 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.477 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 33.7 mt -98.18 -16.69 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.432 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 46.1 mm-40 77.94 -54.84 0.51 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.864 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -74.42 -52.93 10.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -55.75 -29.36 59.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.28 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.5 mm -60.07 -50.05 81.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.713 179.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.6 -20.94 63.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.201 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -82.68 -40.52 20.56 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.832 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -70.76 -26.23 63.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.194 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 85.3 mt -83.41 -46.22 18.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.2 ttmt -63.81 -37.69 88.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.267 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 12.8 mmmm -75.23 -31.86 60.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -58.96 -58.89 6.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.72 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.441 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 46.5 m-85 -69.91 -30.71 68.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -64.65 -34.12 77.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.964 0.411 . . . . 0.0 110.96 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.55 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -90.27 30.43 1.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.816 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -152.75 -43.49 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.352 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.57 0.45 15.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.757 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.412 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 5.3 m120 62.71 156.82 0.12 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.711 0.291 . . . . 0.0 111.287 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.418 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 11.2 Cg_endo -54.49 173.52 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.862 2.375 . . . . 0.0 112.212 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.418 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 89.7 m -117.8 128.16 54.59 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.226 0.611 . . . . 0.0 110.463 -0.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.648 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 3.1 m95 -119.3 -168.67 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.053 0.454 . . . . 0.0 111.047 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -168.25 63.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.407 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 60.1 m -48.4 138.34 10.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.113 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.489 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 20.0 mm -114.48 140.99 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.743 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.408 ' N ' HG21 ' A' ' 57' ' ' ILE . 48.7 t -141.1 76.95 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.95 179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.74 -66.93 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.284 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -154.97 -80.9 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.741 0.305 . . . . 0.0 111.057 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.489 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.92 17.88 0.12 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.324 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.489 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.1 p90 -52.8 -20.7 3.42 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 65' ' ' TYR . . . -58.52 -60.59 8.66 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.158 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p 49.6 26.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 13.8 m-30 -111.81 41.37 1.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.922 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 49.0 t -75.53 -71.34 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.815 0.34 . . . . 0.0 111.301 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.5 m -76.97 -28.65 55.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.219 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.401 ' ND1' ' O ' ' A' ' 68' ' ' HIS . 26.1 t-80 -54.63 -21.05 9.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.198 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.458 ' HB2' ' HB3' ' A' ' 88' ' ' SER . 10.3 pt-20 -110.01 -55.23 2.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.478 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.426 ' CG2' ' N ' ' A' ' 71' ' ' LYS . 28.3 m -162.89 -101.71 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.074 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.448 ' HE3' ' CE1' ' A' ' 72' ' ' HIS . 0.0 OUTLIER 179.95 25.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.789 0.328 . . . . 0.0 111.383 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.449 ' O ' ' HA ' ' A' ' 86' ' ' PHE . 92.2 m-70 -107.83 68.02 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.967 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.51 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 36.7 p90 -107.04 -174.99 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.216 0.532 . . . . 0.0 111.425 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.407 HD11 ' HA ' ' A' ' 18' ' ' GLN . 12.2 tt -169.65 109.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.5 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.51 ' CE2' ' CE2' ' A' ' 73' ' ' PHE . 56.1 m-85 -89.83 138.85 31.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.762 0.315 . . . . 0.0 111.186 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.488 ' CZ ' HG21 ' A' ' 83' ' ' ILE . 1.9 p90 -166.39 112.13 0.83 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 0.0 110.824 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -91.88 129.36 37.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.3 mt -119.29 134.94 54.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 0.0 111.211 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.18 -103.92 0.14 Allowed Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.798 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 2.0 pp0? -128.12 33.04 4.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.921 0.391 . . . . 0.0 111.189 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 88.6 t -146.06 140.64 21.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.581 179.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -93.25 131.69 38.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.796 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.488 HG21 ' CZ ' ' A' ' 76' ' ' PHE . 63.0 mt -127.4 132.54 69.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.455 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.468 HD22 ' HB ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -144.78 127.38 16.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.056 0.455 . . . . 0.0 111.579 -179.442 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.441 ' CD2' ' CD2' ' A' ' 46' ' ' PHE . 29.8 tp -109.11 141.04 41.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.45 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -157.97 154.73 28.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.003 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.648 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -140.41 154.18 46.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.013 0.435 . . . . 0.0 111.688 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.458 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 92.9 p -81.28 76.86 8.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.079 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.417 ' HA2' ' HE2' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.329 -1.262 . . . . 0.0 112.766 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.2 mtm . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.1 m -150.21 155.34 39.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.884 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 54.2 p-10 -163.96 75.56 0.33 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.009 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 74.8 mtt-85 -80.78 -46.71 14.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.719 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp 59.56 80.4 0.2 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.48 128.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.069 179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.2 t -144.36 88.68 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.028 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.424 HD13 HG22 ' A' ' 8' ' ' ILE . 79.5 mt -59.41 129.15 21.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -112.02 -23.11 10.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.188 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -165.48 85.6 0.37 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.882 0.372 . . . . 0.0 110.863 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -106.97 95.69 5.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.878 179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.51 -11.16 59.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.368 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.464 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 43.4 tpp -78.34 158.73 28.72 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.708 0.29 . . . . 0.0 110.735 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -41.63 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.205 -179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.466 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 44.7 tt0 -178.27 -31.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.58 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -55.42 -32.17 62.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.844 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.464 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.1 mpt? -77.24 -24.84 51.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.563 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.469 ' OE1' ' N ' ' A' ' 18' ' ' GLN . 2.0 mp0 -66.67 -45.46 78.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.21 -32.1 29.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.308 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.412 ' OD2' ' CE1' ' A' ' 46' ' ' PHE . 67.7 t0 -75.35 -47.55 27.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 110.656 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.468 ' CB ' ' CE2' ' A' ' 76' ' ' PHE . . . -66.45 -49.14 67.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.139 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.453 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 86.2 t -60.23 -41.61 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.79 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -77.12 -31.68 55.93 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.625 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 37.9 t -72.07 -29.81 64.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.1 -26.89 33.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.977 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.3 m -78.9 -45.78 19.85 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.728 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -72.35 -28.35 62.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -67.53 -56.17 10.59 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.391 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 67.1 mtm -70.11 -20.15 63.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.643 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -81.14 -45.03 17.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -83.78 -26.33 29.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.7 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -137.65 170.03 16.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -154.48 54.79 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 21.4 mt -108.11 -11.11 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.477 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 7.9 mp0 72.69 -54.47 0.69 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.093 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -75.69 -50.23 16.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -57.16 -29.1 63.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.418 179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.6 mm -60.9 -49.79 83.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.476 179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.78 -23.66 63.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -75.99 -45.09 36.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.195 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.417 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.4 t80 -67.68 -25.82 65.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.902 0.382 . . . . 0.0 110.391 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.416 HG22 ' CE2' ' A' ' 46' ' ' PHE . 88.6 mt -80.92 -49.46 18.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.908 179.172 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.528 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -68.33 -31.48 70.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.072 179.068 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 29.7 mmmt -72.51 -42.32 64.94 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.316 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -70.35 -27.88 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.437 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.485 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 32.2 m-85 -89.01 -38.87 14.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.539 0.209 . . . . 0.0 111.502 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.62 -25.43 49.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.0 111.175 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -87.17 -11.97 48.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.193 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -110.22 -53.68 2.65 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.665 0.269 . . . . 0.0 111.21 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 52.5 m-85 -94.97 16.54 15.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.637 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.6 t30 62.61 138.68 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.55 0.214 . . . . 0.0 110.851 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.52 172.49 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.248 1.965 . . . . 0.0 112.125 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.0 m -120.97 125.61 47.82 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.134 0.574 . . . . 0.0 110.789 0.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.493 ' HB3' HD12 ' A' ' 85' ' ' LEU . 8.9 m95 -114.08 174.36 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.516 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.408 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 92.2 m-70 -157.52 92.58 1.23 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.078 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.9 t -79.24 137.71 37.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.534 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.512 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 13.8 mm -112.73 145.88 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 120.748 0.308 . . . . 0.0 111.508 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.456 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 14.1 p -123.61 75.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.684 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -178.06 -88.95 0.07 OUTLIER Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.735 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -135.29 -84.16 0.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.641 0.258 . . . . 0.0 111.318 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.479 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -151.11 12.79 0.67 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.651 -179.816 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.6 p90 -60.01 -14.86 18.26 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.425 ' HA3' ' CD1' ' A' ' 57' ' ' ILE . . . -117.14 43.47 1.63 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.013 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.7 p -97.12 63.72 1.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.887 0.375 . . . . 0.0 110.635 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -119.99 45.15 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.54 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.437 HG11 ' HB3' ' A' ' 86' ' ' PHE . 97.4 t -130.82 -38.22 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.898 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -49.61 -27.31 4.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.32 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 79.1 t60 -81.92 5.97 17.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.869 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.517 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 17.5 tp10 -114.61 -33.91 5.38 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.784 0.325 . . . . 0.0 111.456 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.687 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 18.9 m -158.96 -95.97 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.887 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.687 ' HB3' ' O ' ' A' ' 70' ' ' THR . 0.0 OUTLIER 156.36 2.23 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 178.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.43 ' CE1' ' HE2' ' A' ' 71' ' ' LYS . 20.3 m80 -79.2 60.96 3.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.162 0.506 . . . . 0.0 109.93 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 40.3 p90 -111.83 -168.14 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.926 -178.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.433 HD13 ' HA ' ' A' ' 18' ' ' GLN . 7.1 tt -168.57 148.99 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.265 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -128.19 153.15 47.22 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.006 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.587 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 19.0 p90 -170.2 123.96 0.72 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.358 0.599 . . . . 0.0 111.354 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -84.41 118.81 24.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.154 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.6 mt -116.32 117.63 30.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.716 179.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.48 -105.75 0.79 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.338 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -126.36 30.19 5.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 111.269 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 85.2 t -142.53 133.81 24.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.37 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.53 118.51 31.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.587 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 2.6 mp -103.11 137.04 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.009 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.508 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -137.31 116.22 12.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.168 0.509 . . . . 0.0 111.899 -179.378 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.493 HD12 ' HB3' ' A' ' 54' ' ' TRP . 63.9 tp -107.18 135.27 48.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.364 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.567 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.5 m-85 -130.75 176.12 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 0.0 112.24 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.444 ' CG ' ' CE2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -141.82 85.62 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.474 179.433 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.517 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 99.1 p -71.07 108.0 4.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.818 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.08 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.558 179.938 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.4 mtp . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.855 0.36 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 t -146.98 68.36 1.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.822 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -108.57 39.5 1.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 63.4 mtt85 -149.63 177.01 10.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -135.4 42.79 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.833 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -176.32 82.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.896 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 24.0 t -133.14 152.13 35.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.469 HG12 ' HB3' ' A' ' 76' ' ' PHE . 37.5 mt -115.74 114.95 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.509 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -75.02 -38.24 61.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.1 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.599 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 0.9 OUTLIER -164.0 119.0 1.54 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.851 0.358 . . . . 0.0 110.73 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.489 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -143.89 140.03 29.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.373 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -131.9 7.68 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.619 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.504 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 52.2 tpp -72.0 62.96 0.47 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.981 0.42 . . . . 0.0 111.409 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 42.2 t 68.34 -63.22 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.414 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.539 ' HB2' ' O ' ' A' ' 14' ' ' SER . 41.2 tt0 150.56 -49.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.702 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -52.89 -24.87 10.08 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.873 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.504 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.8 mpt? -81.85 -25.22 35.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.28 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.496 ' NE2' ' HA ' ' A' ' 15' ' ' GLU . 58.9 mt-30 -65.75 -42.27 91.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -74.94 -39.79 61.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.185 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.58 -53.81 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.908 0.385 . . . . 0.0 110.764 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.55 -51.48 65.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.309 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.454 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 70.7 t -56.46 -53.76 36.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -68.46 -23.26 64.57 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.854 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.5 t -72.6 -34.09 67.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.72 -27.06 44.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.827 178.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.9 m -77.06 -49.28 15.69 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.954 179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -69.67 -25.6 63.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.285 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -72.63 -42.04 64.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.535 179.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.6 ttm -71.5 -31.26 66.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.738 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -79.35 -46.78 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.264 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -77.04 -21.47 54.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -144.37 149.43 36.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.842 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -136.85 43.22 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.029 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.6 mt -99.43 -16.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.418 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.4 mt-10 77.55 -54.81 0.53 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.005 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.485 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -75.33 -50.84 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.256 179.577 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.84 -28.12 54.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.08 0.467 . . . . 0.0 110.112 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.3 mm -61.94 -57.87 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.416 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.15 -24.46 58.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.926 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.527 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -77.81 -42.45 33.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.017 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -69.41 -21.91 63.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.3 mt -81.62 -50.36 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.485 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 18.6 ptpt -66.17 -38.64 88.55 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.662 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 1.1 mptm? -65.53 -45.87 81.77 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.58 -44.44 76.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -74.34 -32.47 62.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.389 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.406 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 47.5 m-20 -74.32 -26.69 60.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.698 0.285 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -88.74 -15.62 34.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.512 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -111.96 -26.94 8.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.537 0.208 . . . . 0.0 111.311 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.417 ' CZ ' ' HE2' ' A' ' 17' ' ' MET . 46.2 m-85 -117.96 1.94 12.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.538 -179.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 61.73 153.46 0.11 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.69 0.281 . . . . 0.0 111.005 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 170.91 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.643 2.229 . . . . 0.0 112.145 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -117.74 119.89 36.29 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.05 0.54 . . . . 0.0 110.294 -0.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.596 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 21.9 m95 -108.63 -172.28 2.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.227 0.537 . . . . 0.0 111.596 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.433 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 15.3 t-160 -171.77 115.44 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.911 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.5 t -102.09 145.58 29.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.954 0.407 . . . . 0.0 111.33 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.478 HG21 ' CE1' ' A' ' 62' ' ' PHE . 27.3 mm -111.71 143.13 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.603 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.45 ' N ' HG22 ' A' ' 57' ' ' ILE . 7.2 p -129.88 58.91 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.566 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -148.02 -109.74 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.859 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -123.43 -65.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.86 0.362 . . . . 0.0 111.38 -179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.555 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.06 20.81 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.55 -179.361 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.478 ' CE1' HG21 ' A' ' 57' ' ' ILE . 15.0 p90 -76.32 17.04 0.39 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.562 -177.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.402 ' H ' ' C ' ' A' ' 61' ' ' ASN . . . -87.63 28.69 5.73 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.016 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -71.87 57.71 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.258 0.552 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.568 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 65.9 t80 -146.28 24.53 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.347 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.498 ' HA ' ' CD2' ' A' ' 86' ' ' PHE . 43.6 t -85.96 -54.99 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.774 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 89.5 m -50.91 -32.8 21.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.055 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -54.57 -23.41 16.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.217 0.532 . . . . 0.0 109.728 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.524 ' HB3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -93.71 -76.34 0.48 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.219 179.06 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.508 ' OG1' ' HD2' ' A' ' 71' ' ' LYS . 1.8 t -163.45 -107.95 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.818 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.508 ' HD2' ' OG1' ' A' ' 70' ' ' THR . 0.0 OUTLIER -153.2 32.21 0.47 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.001 0.429 . . . . 0.0 110.899 179.298 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 37.9 m170 -109.24 72.16 0.8 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.451 179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.465 ' O ' ' HB2' ' A' ' 13' ' ' MET . 30.5 p90 -106.04 -172.14 2.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.293 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.489 HG13 ' CB ' ' A' ' 11' ' ' ALA . 5.1 tt 166.37 107.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.007 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.599 ' CE2' ' HB3' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -119.24 163.68 16.75 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.162 0.506 . . . . 0.0 111.619 178.855 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.512 ' HB2' ' O ' ' A' ' 7' ' ' VAL . 5.9 p90 -155.09 162.49 41.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.742 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -119.3 133.46 55.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.053 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.413 ' O ' ' CD1' ' A' ' 78' ' ' LEU . 2.9 pp -140.47 141.0 35.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.979 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.57 -97.25 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.636 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -141.19 29.62 1.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.914 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -140.72 133.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.862 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -100.0 128.62 46.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.01 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.469 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 65.9 mt -115.51 138.26 46.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.57 ' HA ' ' HB3' ' A' ' 75' ' ' TYR . 5.4 tt -130.18 117.04 19.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.612 -179.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 66.1 tp -109.7 144.17 38.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.553 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.498 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 3.8 p90 -165.06 179.79 6.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.596 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -168.85 -177.98 3.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.132 0.491 . . . . 0.0 111.752 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.524 ' HA ' ' HB3' ' A' ' 69' ' ' GLU . 78.5 p -111.57 76.66 0.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.249 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.46 ' N ' ' HD3' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.511 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.806 0.336 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p 50.4 -175.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -162.57 85.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.9 mtt85 -152.57 -175.77 5.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.57 ' HE3' ' HA ' ' A' ' 5' ' ' LYS . 1.5 tpmt? -168.79 97.48 0.38 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.73 101.04 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.08 -179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -141.06 104.72 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.479 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -81.81 91.63 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.916 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -57.16 -19.18 18.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.722 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 49.5 t30 179.17 130.96 0.08 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.359 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -120.92 130.66 53.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.594 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -132.58 3.39 3.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.451 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.494 ' HG2' ' C ' ' A' ' 73' ' ' PHE . 68.3 mmm -97.45 49.07 1.04 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.028 0.442 . . . . 0.0 111.669 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.493 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 51.1 m 70.48 -63.05 0.42 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.715 178.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.638 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 10.2 pt-20 159.23 -42.25 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.651 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -52.5 -33.2 43.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.995 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -72.64 -28.29 62.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.199 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.638 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 55.8 mm-40 -63.26 -50.14 71.31 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.54 -34.02 64.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.081 179.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 39.1 t70 -74.89 -64.18 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 110.463 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.3 -46.26 46.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.32 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.502 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 53.8 t -59.29 -54.61 31.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.984 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.76 -29.07 69.89 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.636 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 73.8 m -71.32 -34.0 70.17 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -28.45 51.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.62 178.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 86.7 m -74.58 -51.39 14.71 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.609 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.448 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -68.1 -23.96 64.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.367 178.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.5 -46.57 63.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 93.6 mmm -70.45 -29.83 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.968 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -78.39 -47.71 17.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.356 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -75.8 -21.23 57.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.75 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -140.76 140.1 34.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.858 0.361 . . . . 0.0 111.03 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -111.02 29.28 7.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.424 ' O ' ' CG1' ' A' ' 38' ' ' ILE . 9.5 mt -116.46 172.27 4.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -111.03 15.12 21.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.712 0.291 . . . . 0.0 111.296 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -119.48 -52.96 2.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.836 0.35 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.81 -23.51 52.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.012 0.434 . . . . 0.0 109.912 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.424 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 37.3 mm -65.57 -57.34 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.681 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.67 62.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.42 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -83.86 -41.55 17.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.966 0.412 . . . . 0.0 110.959 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.453 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -73.35 -22.55 60.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -86.39 -43.05 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.381 0.61 . . . . 0.0 109.459 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.523 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -71.66 -37.09 70.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.728 179.111 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.42 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.5 mttt -75.7 -44.03 44.21 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.3 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.443 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . 37.6 tt0 -61.69 -36.48 81.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.444 ' CZ ' ' OD2' ' A' ' 20' ' ' ASP . 7.9 m-85 -74.92 -40.62 60.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.64 0.257 . . . . 0.0 111.517 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.99 -14.46 60.23 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.443 ' HG2' ' HA ' ' A' ' 45' ' ' GLU . 4.0 ptpp? -82.91 3.94 27.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.929 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -152.25 -44.79 0.1 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.444 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -78.69 -4.1 47.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.372 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 62.99 141.62 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.707 0.289 . . . . 0.0 110.709 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.9 170.67 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.366 2.044 . . . . 0.0 112.163 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.6 t -120.97 111.51 17.59 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.089 0.556 . . . . 0.0 110.576 -0.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.506 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 10.3 m95 -101.46 168.49 9.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.06 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -151.81 99.48 2.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.758 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 29.4 p -90.78 130.0 36.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.504 ' CG2' ' CZ ' ' A' ' 62' ' ' PHE . 11.9 mm -109.3 149.6 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 49.0 t -134.79 90.07 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.984 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 175.56 -74.12 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.332 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.0 mtp85 -153.11 -78.64 0.11 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.887 0.375 . . . . 0.0 111.279 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.533 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.01 24.22 0.11 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.758 -179.572 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.504 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.8 p90 -67.83 8.58 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.464 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -64.95 -67.01 2.19 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.282 -0.961 . . . . 0.0 111.945 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 24.9 m 78.55 41.04 0.11 Allowed 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.416 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 5.3 p90 -179.31 65.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.807 0.337 . . . . 0.0 111.026 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.473 ' HA ' ' CD2' ' A' ' 86' ' ' PHE . 44.6 t -97.58 -63.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.202 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -90.71 -27.94 18.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.905 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -52.68 -22.2 4.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.311 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.514 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 22.5 pt-20 -90.44 -59.56 2.15 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.225 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.552 HG21 ' HA ' ' A' ' 88' ' ' SER . 4.6 t -147.4 -112.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 179.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.469 ' H ' ' CG2' ' A' ' 70' ' ' THR . 0.0 OUTLIER -166.58 33.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.078 0.466 . . . . 0.0 110.261 179.466 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -120.48 76.36 1.18 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.129 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.516 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 30.9 p90 -126.99 151.07 49.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.673 -178.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.453 ' HB ' ' HB2' ' A' ' 13' ' ' MET . 7.9 tt -133.6 128.43 54.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 178.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.516 ' CE2' ' CE2' ' A' ' 73' ' ' PHE . 32.5 m-85 -112.74 138.91 48.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.227 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.507 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 16.7 p90 -162.88 129.64 3.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.235 0.541 . . . . 0.0 110.955 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -92.36 150.15 21.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 90.5 mt -149.21 130.5 14.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.937 0.399 . . . . 0.0 111.104 -179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.08 -98.47 0.03 OUTLIER Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.916 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -136.14 31.87 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 0.0 110.85 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 60.8 t -148.61 137.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.972 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.43 133.96 41.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.022 179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.507 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 68.1 mt -117.78 138.14 49.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.478 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.472 ' CD2' ' HB ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -133.93 103.41 5.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 0.0 111.368 -179.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.474 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 44.8 tp -96.39 108.46 20.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.594 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.473 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.6 p90 -132.81 142.75 49.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.182 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.506 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -123.24 150.99 42.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.627 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.552 ' HA ' HG21 ' A' ' 70' ' ' THR . 82.7 p -93.64 165.36 12.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.525 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.7 mtp . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.796 0.332 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.4 p -60.33 119.72 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.919 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -149.69 79.87 1.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.933 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -130.33 28.2 4.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -104.06 31.44 4.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 63.53 134.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.135 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.4 t -149.7 153.69 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.006 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.454 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 59.6 mt -130.42 115.79 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.043 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.03 -30.65 34.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.711 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -159.03 133.37 7.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -116.98 128.57 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.134 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -122.32 -16.01 7.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.523 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 17' ' ' MET . 50.3 tpp -88.53 50.56 1.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.106 0.479 . . . . 0.0 111.822 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.614 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 49.7 m 67.79 -65.25 0.25 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.821 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.648 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 tm-20 166.74 -36.18 0.0 OUTLIER 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.567 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 17' ' ' MET . 2.7 p30 -51.35 -40.78 59.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.805 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.499 ' HB3' ' HB3' ' A' ' 13' ' ' MET . 44.8 ttm -72.24 -18.59 61.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.503 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.648 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 71.8 mm-40 -66.51 -48.4 69.91 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -69.8 -38.61 76.68 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.863 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -72.15 -63.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.211 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.15 -44.92 32.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.316 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.479 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 55.4 t -60.6 -53.31 50.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.035 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.71 -29.85 71.03 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.694 0.283 . . . . 0.0 110.733 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 73.1 m -71.78 -31.46 66.63 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.44 -24.31 31.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.056 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.1 m -80.68 -42.57 21.8 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -75.36 -29.0 59.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.064 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.85 -47.24 60.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.523 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.3 -23.61 59.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.763 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -77.37 -51.12 11.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.4 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -81.34 -24.78 36.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.083 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -135.35 168.85 18.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -159.14 44.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.066 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.5 mt -96.83 -16.68 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.5 mt-10 79.38 -53.07 0.42 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.095 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.499 ' HD3' ' N ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -79.6 -42.36 25.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.615 0.245 . . . . 0.0 110.863 -179.433 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.499 ' N ' ' HD3' ' A' ' 36' ' ' LYS . 52.6 m-20 -68.86 -17.99 64.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.022 0.439 . . . . 0.0 110.222 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 mm -72.38 -54.06 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.4 -26.93 63.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.978 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -78.16 -38.11 44.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.61 -24.69 64.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.968 0.413 . . . . 0.0 110.341 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.422 HG21 HD12 ' A' ' 42' ' ' ILE . 84.3 mt -77.84 -53.28 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.755 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.477 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 64.7 pttt -66.02 -35.88 81.75 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.657 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 14.0 tppt? -61.66 -47.23 86.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -58.75 -52.47 65.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.265 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.456 ' CE2' ' HG3' ' A' ' 17' ' ' MET . 13.2 m-85 -67.77 -29.44 68.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -70.7 -26.62 63.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.021 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.463 ' NZ ' ' HB3' ' A' ' 48' ' ' LYS . 7.2 ttpm? -89.85 -27.47 19.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -95.55 -50.45 4.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.144 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -91.67 9.3 32.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.371 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 60.69 154.25 0.1 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-O 120.782 0.325 . . . . 0.0 110.901 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 172.12 1.82 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.571 2.181 . . . . 0.0 112.055 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 9.0 t -121.96 97.11 5.33 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.957 0.503 . . . . 0.0 110.651 -0.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.458 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 13.6 m95 -90.46 172.16 8.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 77.5 t60 -155.06 105.26 2.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.588 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.0 t -75.48 145.96 41.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.164 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.522 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 35.9 mm -111.89 145.46 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.885 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.499 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 9.6 p -133.53 63.82 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 121.246 0.546 . . . . 0.0 111.503 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -157.1 -92.47 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.448 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -125.75 -84.85 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.715 0.293 . . . . 0.0 111.088 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.474 ' C ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -158.72 15.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.47 -179.811 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.522 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 9.7 p90 -53.97 -46.13 71.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.826 0.346 . . . . 0.0 111.353 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.423 ' HA3' HG23 ' A' ' 66' ' ' VAL . . . 79.47 -21.28 4.51 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.626 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.406 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 26.3 t 70.69 -53.43 0.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.915 0.358 . . . . 0.0 111.123 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -164.88 69.66 0.16 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.124 0.487 . . . . 0.0 111.256 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.468 HG22 ' CD2' ' A' ' 86' ' ' PHE . 42.1 t -91.26 -74.95 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.326 -179.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.8 m -43.6 -29.4 0.48 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.518 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 75.4 m-70 -44.97 -26.77 0.46 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.518 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 12.2 pt-20 167.43 50.14 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.97 0.414 . . . . 0.0 111.158 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.507 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 35.7 m -102.93 -86.89 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.444 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.1 OUTLIER 72.44 -18.24 0.34 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.333 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.45 ' H ' ' C ' ' A' ' 70' ' ' THR . 53.3 m170 -122.23 77.33 1.39 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.738 0.304 . . . . 0.0 110.286 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.438 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 6.4 p90 -125.43 -172.27 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.047 0.451 . . . . 0.0 111.434 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.526 HG13 HE22 ' A' ' 18' ' ' GLN . 9.5 tt -157.8 129.7 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.259 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.539 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 8.2 m-30 -106.63 130.78 54.32 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.518 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.457 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 2.8 p90 -152.73 123.26 7.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.238 0.542 . . . . 0.0 111.411 179.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -93.2 140.7 29.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.721 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.485 ' N ' ' CD2' ' A' ' 78' ' ' LEU . 1.3 pt? -154.17 138.04 16.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.97 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.89 -100.82 0.59 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.541 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -140.99 23.68 2.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.737 0.303 . . . . 0.0 111.003 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 61.1 t -150.78 150.02 13.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.125 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.76 130.47 44.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.018 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.483 HG22 ' O ' ' A' ' 57' ' ' ILE . 66.0 mt -110.34 137.7 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.539 ' HG ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 tt -129.57 119.6 23.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 111.539 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 57.3 tp -109.61 119.75 40.36 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.493 ' CZ ' ' HB3' ' A' ' 55' ' ' HIS . 6.3 p90 -136.87 173.08 12.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.438 0.637 . . . . 0.0 112.45 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -134.9 84.53 2.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.464 179.024 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 80.0 p -72.22 68.22 0.72 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.463 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.432 -1.204 . . . . 0.0 112.447 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 ttp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.828 0.347 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.1 p -121.11 105.01 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -98.5 31.21 2.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.952 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.419 ' NE ' ' HA ' ' A' ' 4' ' ' ARG . 4.9 mmp_? -148.71 -174.03 4.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -155.94 42.47 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.835 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . -160.25 81.13 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.318 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.3 t -134.05 147.01 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.04 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.465 ' CD1' ' HB3' ' A' ' 18' ' ' GLN . 25.7 mt -121.64 112.85 36.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.469 ' NZ ' ' HB3' ' A' ' 9' ' ' LYS . 3.3 mmmp? -66.53 -43.31 85.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.719 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.551 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 49.8 t30 -161.39 138.91 8.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.12 94.99 2.94 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.385 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.465 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 33.5 t70 -80.58 -1.74 43.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.653 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.417 ' HG3' ' N ' ' A' ' 14' ' ' SER . 47.8 tpp -86.18 165.13 16.78 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.417 ' N ' ' HG3' ' A' ' 13' ' ' MET . 80.4 p -36.4 -81.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.757 0.313 . . . . 0.0 111.818 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.411 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 12.0 pt-20 176.76 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.207 0.527 . . . . 0.0 110.184 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -56.8 -24.6 51.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.582 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -80.06 -28.29 39.24 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.448 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.465 ' HB3' ' CD1' ' A' ' 8' ' ' ILE . 57.0 mt-30 -65.18 -47.08 78.25 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.692 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -77.25 -35.43 55.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.212 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.446 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.4 t70 -71.07 -53.33 15.05 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.265 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.66 -49.86 67.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.0 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.429 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 80.1 t -54.65 -49.87 64.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.099 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -71.36 -27.31 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.022 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 95.3 m -71.79 -33.49 68.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.75 39.13 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.968 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.5 m -79.17 -45.75 19.29 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.904 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -73.69 -25.28 60.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.279 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.96 -53.26 13.58 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 66.2 mtt -73.48 -20.7 60.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.101 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -78.04 -50.67 11.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.879 0.371 . . . . 0.0 110.741 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -81.99 -23.61 35.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.141 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -131.89 165.91 22.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.85 0.357 . . . . 0.0 111.05 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -156.02 35.88 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.998 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.467 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 29.7 mt -98.3 -10.58 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.519 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.467 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 78.12 -55.1 0.5 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.105 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.42 -53.04 26.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.676 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.81 -25.39 55.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.4 HD12 HG23 ' A' ' 38' ' ' ILE . 45.3 mm -65.63 -55.86 17.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.499 179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.32 -23.39 64.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.985 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -80.24 -39.0 29.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.851 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.27 -27.16 66.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.406 . . . . 0.0 110.088 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.418 HD13 HG21 ' A' ' 42' ' ' ILE . 76.2 mt -80.85 -48.67 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.652 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -67.23 -31.77 72.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.086 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.1 mttt -80.48 -29.43 37.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.1 -39.5 78.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.823 0.344 . . . . 0.0 111.167 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.477 ' CE2' ' CD2' ' A' ' 85' ' ' LEU . 3.8 m-85 -82.05 -36.09 28.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.257 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.07 -17.63 56.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.434 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 21.8 ptmt -85.59 3.79 39.12 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.446 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.437 ' NZ ' ' HB2' ' A' ' 49' ' ' LYS . 10.4 mtmp? -142.7 -48.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.926 0.393 . . . . 0.0 110.829 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -87.51 6.26 35.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 60.59 156.07 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-O 120.727 0.299 . . . . 0.0 110.721 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 39.8 Cg_exo -56.65 167.03 3.13 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.394 2.063 . . . . 0.0 112.053 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.0 t -139.08 126.98 22.21 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.241 0.616 . . . . 0.0 110.565 0.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.711 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 1.3 m95 -112.19 -171.28 1.82 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.292 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.494 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 50.1 m80 -157.39 58.2 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.281 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.42 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 53.0 t -48.91 133.52 17.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.673 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.495 ' O ' ' HA ' ' A' ' 83' ' ' ILE . 30.9 mm -106.05 142.21 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.687 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.475 ' CG1' ' O ' ' A' ' 58' ' ' VAL . 10.9 p -129.73 72.16 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.477 -179.546 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.66 -92.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.145 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 11.5 mtp-105 -157.59 67.24 0.5 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.653 0.263 . . . . 0.0 110.894 -179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.504 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER 52.15 12.9 0.24 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.394 179.756 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.444 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 5.8 p90 -51.67 -25.87 8.05 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.311 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.412 ' N ' ' CD1' ' A' ' 62' ' ' PHE . . . -121.29 48.06 0.98 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.701 179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -77.6 56.63 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.539 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -98.73 37.7 1.46 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 0.0 110.448 179.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.453 ' CG1' ' HB3' ' A' ' 73' ' ' PHE . 66.2 t -46.15 -54.26 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.597 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -50.8 -32.54 20.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.052 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 19.0 t-160 -53.65 -24.01 12.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.557 ' HA ' ' HB2' ' A' ' 88' ' ' SER . 9.5 mp0 -92.78 -77.51 0.44 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.598 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.49 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 1.8 t -176.55 -95.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.845 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.49 ' H ' ' CG2' ' A' ' 70' ' ' THR . 2.4 mptp? -152.79 22.62 0.59 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.3 m170 -113.12 73.7 0.83 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.987 0.422 . . . . 0.0 110.856 -179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.502 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 5.8 p90 -113.68 -179.87 3.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.801 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.427 ' N ' ' HD1' ' A' ' 73' ' ' PHE . 7.7 tt 176.39 108.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.998 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.551 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 1.1 p90 -113.64 162.57 16.08 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.23 0.538 . . . . 0.0 111.513 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.478 ' CD1' ' N ' ' A' ' 76' ' ' PHE . 1.3 p90 -153.38 159.05 42.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.111 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.403 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 1.4 t80 -109.78 121.5 45.36 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.96 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.403 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 78.7 mt -119.86 112.26 18.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.053 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.41 -90.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.75 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -138.42 31.89 2.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.909 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.6 t -146.55 126.14 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.09 134.9 37.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.27 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.495 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 68.7 mt -115.43 135.8 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.651 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.428 ' HG ' ' CD2' ' A' ' 86' ' ' PHE . 52.1 tp -124.36 107.01 10.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.477 ' CD2' ' CE2' ' A' ' 46' ' ' PHE . 59.8 tp -108.64 130.61 55.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.561 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.502 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 2.9 p90 -157.54 151.85 24.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.336 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.711 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -127.92 152.87 47.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.244 0.545 . . . . 0.0 111.774 -179.604 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.557 ' HB2' ' HA ' ' A' ' 69' ' ' GLU . 33.1 t -100.57 77.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.288 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.465 ' N ' ' HD2' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.406 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.518 ' HA ' ' CE ' ' A' ' 1' ' ' MET . 10.4 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.862 0.363 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t 60.04 31.67 20.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 62.29 90.26 0.08 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.946 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -124.88 42.68 3.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.672 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -113.9 50.01 0.95 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.847 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.434 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . 67.27 108.86 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.21 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.413 ' CD1' ' N ' ' A' ' 8' ' ' ILE . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.504 ' O ' ' CB ' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.504 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.676 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.408 ' O ' ' CB ' ' A' ' 21' ' ' ALA . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.676 ' HG2' ' HA ' ' A' ' 15' ' ' GLU . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 24' ' ' CYS . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.444 ' CG2' ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.4 ' N ' ' O ' ' A' ' 20' ' ' ASP . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.403 ' CE ' HG13 ' A' ' 58' ' ' VAL . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.473 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.42 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CZ3' ' HB2' ' A' ' 87' ' ' LYS . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.491 ' O ' HG21 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.403 HG13 ' CE ' ' A' ' 29' ' ' MET . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.619 ' O ' ' HB3' ' A' ' 61' ' ' ASN . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.619 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.51 ' N ' HD21 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.421 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.417 HG22 ' CE1' ' A' ' 86' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.526 ' CG2' ' H ' ' A' ' 71' ' ' LYS . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.526 ' H ' ' CG2' ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.477 ' CG2' ' HB3' ' A' ' 85' ' ' LEU . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.47 ' CE2' ' CD1' ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.483 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.434 ' CD2' ' HA ' ' A' ' 6' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.434 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.491 HG21 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.476 HD22 ' HB ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.489 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.621 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.621 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' HG23 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -155.29 96.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.1 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' HG2' ' A' ' 18' ' ' GLN . 69.0 mt -79.21 112.43 17.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.948 0.404 . . . . 0.0 110.994 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -80.97 -32.36 34.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.933 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -168.45 114.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.619 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.49 117.96 33.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.452 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.87 -13.68 18.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.844 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 41.9 tpp -75.32 170.91 15.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.377 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.0 t -73.38 38.01 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 68.65 -43.91 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -45.39 -40.22 7.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.619 0.247 . . . . 0.0 111.64 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.527 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -71.91 -26.42 62.3 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.16 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.673 ' HG2' HD13 ' A' ' 8' ' ' ILE . 34.2 mt-30 -64.79 -42.62 94.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -77.09 -40.13 47.14 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.183 178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -70.98 -57.67 4.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.379 . . . . 0.0 110.907 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.688 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -55.21 -49.83 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.534 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 18' ' ' GLN . 61.3 t -57.66 -44.82 86.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.352 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -73.96 -30.63 62.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 85.7 m -71.97 -32.99 67.8 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -80.93 -24.91 37.85 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.252 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.406 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 93.4 m -81.25 -43.83 18.63 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.995 0.426 . . . . 0.0 109.925 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.416 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 17.7 tt0 -74.87 -26.27 59.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.384 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -78.56 -39.39 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.094 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.406 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.4 ptt? -77.21 -26.86 53.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.49 ' OE2' ' HB2' ' A' ' 31' ' ' LYS . 0.8 OUTLIER -87.01 -37.66 17.3 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HB2' ' OE2' ' A' ' 30' ' ' GLU . 24.3 ttmm -79.21 -28.31 42.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.203 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -146.73 176.28 9.98 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.803 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -158.04 27.49 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.173 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 35.6 mm -75.35 -13.03 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.549 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 42.9 mt-10 76.56 -54.46 0.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.036 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -74.81 -50.15 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.94 0.4 . . . . 0.0 110.572 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -56.26 -29.6 61.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.15 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.401 HG23 ' CB ' ' A' ' 28' ' ' ALA . 44.3 mm -62.3 -56.06 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.634 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.75 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.25 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.465 ' O ' ' CB ' ' A' ' 44' ' ' LYS . . . -78.66 -41.49 31.15 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.78 -26.36 65.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.1 mt -80.32 -48.27 20.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.942 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 2.7 pptp? -69.69 -32.67 71.42 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.764 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 51.9 tttp -68.24 -44.98 74.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.939 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.73 -43.4 98.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.1 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.16 -16.71 52.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.615 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -87.0 -43.02 12.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.795 0.331 . . . . 0.0 111.115 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -90.26 21.77 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.649 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -138.0 -42.87 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.659 0.266 . . . . 0.0 111.226 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -111.29 10.6 21.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.664 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 62.5 142.72 0.06 OUTLIER Pre-proline 0 CA--C 1.529 0.165 0 CA-C-O 120.638 0.256 . . . . 0.0 110.898 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -50.0 173.91 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.339 2.026 . . . . 0.0 112.358 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -125.15 112.28 16.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.015 0.526 . . . . 0.0 110.611 -0.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.549 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 7.1 m95 -102.32 -167.29 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.802 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -176.14 90.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.767 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -89.19 144.32 26.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.491 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.608 ' O ' HG23 ' A' ' 83' ' ' ILE . 9.2 mm -115.15 150.94 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.66 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.515 ' HA ' HG12 ' A' ' 83' ' ' ILE . 47.7 t -137.42 91.66 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.267 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.77 -83.55 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.218 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.53 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 64.0 mtm-85 -140.97 -75.86 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.38 . . . . 0.0 111.137 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.6 p-10 -161.07 23.1 0.13 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.895 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.7 p90 -71.91 2.47 5.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -177.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.81 -58.6 13.72 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m 44.69 54.01 6.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.477 ' CG ' ' O ' ' A' ' 65' ' ' TYR . 37.8 t80 -165.77 31.6 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.745 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.662 HG13 ' HB3' ' A' ' 73' ' ' PHE . 59.7 t -84.6 -72.77 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.396 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.6 m -69.64 -26.07 64.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.996 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -46.62 -25.29 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.847 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.526 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 17.1 pt-20 -103.88 -63.6 1.18 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.709 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.817 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.6 t -150.94 -116.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HD2' ' C ' ' A' ' 70' ' ' THR . 7.5 mptt -154.29 30.61 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.685 0.278 . . . . 0.0 110.954 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -105.94 68.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.871 0.367 . . . . 0.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.662 ' HB3' HG13 ' A' ' 66' ' ' VAL . 5.6 p90 -117.74 175.5 5.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.176 0.512 . . . . 0.0 111.434 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 74' ' ' ILE . 9.4 tt -160.4 110.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.359 178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.46 ' CE2' ' CE1' ' A' ' 73' ' ' PHE . 66.4 m-85 -91.4 140.04 30.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.921 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.688 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 24.8 p90 -161.14 121.0 2.65 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 110.079 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.463 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 31.6 t80 -92.6 139.22 30.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.949 -177.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -111.5 162.98 14.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.89 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -51.79 100.14 0.05 OUTLIER Glycine 0 CA--C 1.521 0.418 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.423 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.46 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 71.85 25.09 3.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.149 0.499 . . . . 0.0 110.685 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.484 HG12 ' N ' ' A' ' 82' ' ' ALA . 95.9 t -155.54 158.82 3.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.924 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -132.42 143.12 49.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.704 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.641 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 54.0 mt -140.16 137.78 37.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.724 0.297 . . . . 0.0 110.68 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.667 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -138.12 115.67 11.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 56' ' ' CYS . 56.1 tp -102.18 130.73 48.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.629 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.475 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.3 p90 -151.67 157.71 42.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.549 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -146.62 162.67 37.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.942 -179.798 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.817 ' HA ' HG22 ' A' ' 70' ' ' THR . 93.4 p -94.07 167.8 11.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.054 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.528 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.157 0 CA-C-O 120.639 0.257 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.8 t -148.79 107.98 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.759 HD13 ' OE1' ' A' ' 18' ' ' GLN . 68.4 mt -86.05 115.85 28.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.899 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -84.84 -31.08 24.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.621 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -171.9 112.08 0.3 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.723 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -132.06 105.94 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.036 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.426 ' OD1' ' CD1' ' A' ' 73' ' ' PHE . 12.6 p-10 -77.63 -4.41 45.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.245 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.503 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.3 tpp -75.02 165.77 24.73 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' CG ' ' A' ' 15' ' ' GLU . 79.8 p -50.54 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.669 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 47.4 mt-10 -162.99 -36.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.55 0.691 . . . . 0.0 110.194 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.53 -27.64 57.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.503 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.9 mpt? -77.67 -25.35 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.441 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.759 ' OE1' HD13 ' A' ' 8' ' ' ILE . 41.2 mm-40 -65.51 -50.12 66.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -77.48 -32.47 54.36 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.688 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.1 t0 -73.64 -50.4 21.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.858 0.361 . . . . 0.0 110.602 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -59.82 -47.77 84.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.315 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -58.76 -51.61 69.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.066 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.21 -28.39 65.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.556 0.217 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 24.7 t -71.48 -32.34 68.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.01 -25.55 37.12 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.115 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.1 m -79.55 -45.11 19.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.119 0.485 . . . . 0.0 109.811 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.51 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 86.3 mt-30 -73.12 -26.34 61.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.324 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.67 -39.96 50.49 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.075 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -73.1 -32.33 64.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.51 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 12.4 pt-20 -80.58 -45.28 17.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.104 0.478 . . . . 0.0 109.758 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.402 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 57.0 tptt -71.52 -20.82 61.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.673 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -142.49 133.14 25.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.903 0.382 . . . . 0.0 111.088 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -102.72 29.94 5.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.492 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.512 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.8 mt -115.11 168.79 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.512 ' H ' HG22 ' A' ' 34' ' ' ILE . 16.7 pt-20 -113.24 18.87 17.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.524 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -125.97 -44.39 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.732 0.301 . . . . 0.0 110.223 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -68.2 -17.09 64.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.444 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 40.1 mm -69.63 -51.76 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.399 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.78 -22.16 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.108 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.66 -38.89 25.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' A' ' 45' ' ' GLU . 6.5 t80 -70.54 -26.31 63.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.19 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.418 HG21 ' CB ' ' A' ' 56' ' ' CYS . 78.6 mt -84.01 -43.85 17.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 62.8 tttp -67.26 -35.6 79.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.64 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 26.6 tptp -68.86 -59.89 2.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.387 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' A' ' 41' ' ' TYR . 5.4 mm-40 -49.57 -51.72 35.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.89 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.66 ' CD2' HD21 ' A' ' 85' ' ' LEU . 14.6 m-85 -67.75 -31.23 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.395 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 6.3 t70 -73.58 -26.27 60.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -90.05 -24.77 21.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.98 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -95.76 -57.91 2.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.202 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -94.69 17.05 14.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 58.98 161.17 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.33 170.2 15.29 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.602 2.201 . . . . 0.0 111.922 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.0 m -124.5 104.73 8.89 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.282 0.633 . . . . 0.0 110.572 -0.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.453 ' HZ3' ' HE3' ' A' ' 13' ' ' MET . 7.3 m95 -99.9 -171.11 1.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.59 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 77.9 t60 -179.98 85.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.955 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.832 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -66.65 153.28 43.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.861 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.899 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.6 mm -118.16 138.73 47.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.282 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.615 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.6 p -119.48 62.39 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.46 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.68 -92.73 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.597 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.826 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 79.0 mtt-85 -144.94 -65.25 0.34 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.0 111.349 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.1 p-10 -156.87 19.3 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.843 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.673 ' CE1' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -67.49 5.16 0.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.14 57.82 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.878 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.9 m -69.08 55.47 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.027 0.441 . . . . 0.0 111.662 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 4.7 m-85 -99.22 35.11 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.55 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 66' ' ' VAL . 44.2 t -98.48 -1.34 10.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.791 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.9 m -115.55 -27.7 7.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 0.0 111.043 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.554 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 36.1 m80 -50.12 -26.43 4.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.242 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 22.6 pt-20 156.66 45.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 120.889 0.376 . . . . 0.0 110.975 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 20.0 m -94.04 -84.05 0.32 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.481 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 74.84 -12.41 0.94 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.536 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.443 ' H ' HG22 ' A' ' 70' ' ' THR . 9.0 t-160 -139.02 82.87 1.92 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.527 ' HD1' ' N ' ' A' ' 74' ' ' ILE . 7.7 p90 -110.51 -172.3 2.0 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.085 0.469 . . . . 0.0 111.753 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.723 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.5 tt -160.93 113.16 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.749 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 8.1 m-30 -100.94 153.72 19.28 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.484 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 20.6 p90 -170.27 137.49 1.5 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.721 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.458 ' O ' HD23 ' A' ' 78' ' ' LEU . 1.3 t80 -93.67 134.24 36.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.158 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.897 HD12 HD12 ' A' ' 83' ' ' ILE . 81.4 mt -131.72 125.44 32.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.84 -110.94 1.42 Allowed Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.086 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.433 ' C ' HG23 ' A' ' 81' ' ' VAL . 50.8 mm-40 -128.61 49.65 2.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.346 0.593 . . . . 0.0 110.603 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.433 HG23 ' C ' ' A' ' 80' ' ' GLN . 91.7 t -160.2 138.61 2.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.638 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.826 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -83.91 134.06 34.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.272 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.899 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.3 mt -135.69 133.41 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.724 HD13 ' N ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -148.87 143.89 26.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.743 -0.783 . . . . 0.0 112.474 -179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' ' 56' ' ' CYS . 61.1 tp -116.81 155.99 28.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.271 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.464 ' H ' HD12 ' A' ' 85' ' ' LEU . 10.9 p90 -164.3 158.68 19.04 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 0.0 111.977 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.44 ' HB2' ' CH2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -108.25 76.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.737 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 81.2 p -74.91 73.97 2.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.407 -1.219 . . . . 0.0 112.56 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 52.0 p-10 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.482 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 2.5 m-70 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.65 0.262 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.443 HG12 ' N ' ' A' ' 8' ' ' ILE . 45.1 t -147.9 155.17 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.992 0.425 . . . . 0.0 111.635 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.817 HD11 ' HB3' ' A' ' 18' ' ' GLN . 77.6 mt -130.11 123.19 55.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.668 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -87.14 -31.93 20.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.442 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -178.99 110.92 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.607 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.776 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -156.1 144.95 20.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.191 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.486 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.3 t70 -143.47 18.22 1.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.61 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.499 ' CG ' ' HG3' ' A' ' 17' ' ' MET . 50.3 tpp -69.5 65.65 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.69 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 47.1 t 56.97 12.7 1.27 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 47.6 mt-10 69.35 -49.77 0.61 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -46.31 -36.16 6.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.646 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.624 ' HB2' HD12 ' A' ' 74' ' ' ILE . 21.8 mmt -75.84 -24.41 55.81 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.769 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.817 ' HB3' HD11 ' A' ' 8' ' ' ILE . 64.9 mt-30 -67.02 -41.7 86.16 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -82.53 -34.54 27.86 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.021 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' OD1' ' A' ' 23' ' ' ASP . 7.8 t0 -74.81 -37.76 62.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.154 0.502 . . . . 0.0 110.527 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.465 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -71.01 -45.66 63.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.708 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 18' ' ' GLN . 73.9 t -59.43 -55.11 25.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.266 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 20' ' ' ASP . 57.7 p30 -67.25 -25.23 65.98 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.057 -0.257 . . . . 0.0 110.987 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 54.1 t -72.46 -36.53 68.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -75.12 -26.33 59.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.645 178.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -76.65 -53.97 7.3 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.745 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.419 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -63.4 -24.57 67.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.451 178.959 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.02 58.42 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.64 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.6 ptp -75.75 -24.6 56.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.131 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -79.35 -51.01 9.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.0 110.075 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -72.16 -27.12 62.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.575 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -135.3 146.79 48.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.753 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -134.44 42.57 2.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.027 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.5 mt -101.43 -13.31 8.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.555 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.9 mt-10 76.85 -54.51 0.57 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.212 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -71.98 -56.03 6.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.485 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.465 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.07 -25.49 31.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.249 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.61 -49.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.38 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.736 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -65.15 -22.58 66.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.161 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.55 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.74 -40.42 22.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.403 ' O ' ' CD1' ' A' ' 41' ' ' TYR . 5.4 t80 -68.36 -28.35 67.05 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.33 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 25' ' ' ALA . 96.5 mt -77.36 -49.92 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.985 179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.6 ptmt -65.34 -36.26 83.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.55 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.7 tptm -55.24 -55.55 30.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.65 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.06 -54.97 38.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.839 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.444 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.8 m-85 -63.54 -20.05 65.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.263 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -74.44 -56.31 4.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.656 0.265 . . . . 0.0 111.255 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HE2' ' CE ' ' A' ' 44' ' ' LYS . 68.1 mttm -87.0 7.81 26.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.757 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -114.37 -29.89 6.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 111.025 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CZ ' ' CE ' ' A' ' 17' ' ' MET . 48.6 m-85 -130.37 6.55 4.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.42 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.53 150.63 0.1 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-O 120.636 0.255 . . . . 0.0 111.049 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -56.92 172.55 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.526 2.151 . . . . 0.0 112.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -121.97 126.4 48.49 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.105 0.562 . . . . 0.0 110.709 -0.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.482 ' CZ2' ' HG2' ' A' ' 87' ' ' LYS . 3.6 m95 -122.29 172.17 8.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.758 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.412 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 37.9 m80 -149.74 81.62 1.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.327 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.662 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.2 p -72.9 138.38 46.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.799 ' O ' HG23 ' A' ' 83' ' ' ILE . 29.2 mm -109.04 147.15 13.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.379 179.274 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.736 HG21 ' HB2' ' A' ' 39' ' ' ALA . 52.9 t -129.44 74.27 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.713 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 178.94 -100.16 0.14 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.383 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -126.68 -77.1 0.58 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 120.881 0.372 . . . . 0.0 110.882 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.8 p-10 -156.53 19.44 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.091 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.656 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 8.1 p90 -58.62 -15.53 12.0 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.62 54.26 0.76 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.46 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.446 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 41.0 t -60.88 -95.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.412 ' OH ' ' HB3' ' A' ' 55' ' ' HIS . 36.9 p90 41.71 37.87 0.83 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.476 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.977 HG22 ' CE1' ' A' ' 86' ' ' PHE . 47.6 t -60.07 -39.04 79.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.1 m -68.94 -29.13 67.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -49.79 -26.09 3.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 110.27 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 8.8 mp0 -82.01 -77.25 0.23 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.416 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.2 t -172.42 -86.63 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.272 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.825 ' H ' HG23 ' A' ' 70' ' ' THR . 1.5 tptm -166.95 29.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.214 0.53 . . . . 0.0 109.841 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.422 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 93.4 m-70 -129.29 81.27 2.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.618 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 5.9 p90 -112.7 179.06 4.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.929 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.776 HG13 ' HB1' ' A' ' 11' ' ' ALA . 8.0 tt -162.29 111.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.457 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.904 ' OH ' HG21 ' A' ' 66' ' ' VAL . 7.0 m-30 -100.61 151.03 22.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.465 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 1.7 p90 -168.18 116.4 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.967 0.413 . . . . 0.0 110.802 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.657 ' O ' HD23 ' A' ' 78' ' ' LEU . 4.3 t80 -84.7 141.14 30.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.89 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 77' ' ' TYR . 80.0 mt -139.05 135.8 34.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.18 -93.15 0.01 OUTLIER Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.761 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.907 ' OE1' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -139.93 20.9 2.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.688 0.28 . . . . 0.0 111.608 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.907 HG23 ' OE1' ' A' ' 80' ' ' GLN . 92.3 t -140.26 129.95 28.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.87 0.367 . . . . 0.0 110.862 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -89.08 128.53 35.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.818 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.799 HG23 ' O ' ' A' ' 57' ' ' ILE . 59.7 mt -104.11 135.87 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.844 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.578 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 10.2 mp -122.42 107.45 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.609 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 56' ' ' CYS . 65.4 tp -110.01 120.35 42.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.872 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.977 ' CE1' HG22 ' A' ' 66' ' ' VAL . 1.5 m-85 -111.1 165.14 12.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.868 0.366 . . . . 0.0 111.055 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HG2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -136.44 117.72 14.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.659 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 70' ' ' THR . 46.1 t -98.41 151.81 20.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.913 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.537 179.923 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.845 0.355 . . . . 0.0 111.023 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.508 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 55.4 t -143.83 138.83 25.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.096 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.878 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.1 mp -103.97 136.44 37.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.206 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 61.7 mttp -94.28 29.0 2.32 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.577 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.715 ' H ' HG22 ' A' ' 8' ' ' ILE . 45.1 t30 87.68 106.68 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.328 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.467 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -126.88 179.05 5.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.05 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -168.6 19.22 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.541 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 44.8 ttp -80.35 62.88 4.63 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.206 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 45.6 m 72.55 1.57 4.03 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' SER . 46.7 mt-10 70.5 -51.18 0.66 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.783 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -48.26 -29.25 3.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.945 0.402 . . . . 0.0 110.326 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.485 ' HG2' ' HE3' ' A' ' 13' ' ' MET . 1.0 OUTLIER -72.72 -29.86 63.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.464 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.872 ' HA ' HD11 ' A' ' 74' ' ' ILE . 35.2 mt-30 -65.29 -38.33 89.89 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -73.63 -44.43 57.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.39 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.71 -54.33 9.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.258 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.516 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -55.35 -52.1 64.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.425 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 18' ' ' GLN . 78.1 t -57.6 -50.56 76.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.036 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.3 m-20 -69.79 -24.75 63.54 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.787 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -71.75 -38.05 70.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.62 -23.02 53.38 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.779 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.402 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 89.3 m -78.92 -50.88 10.47 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.526 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 23.9 pt20 -69.74 -23.92 63.46 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.373 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.431 ' C ' HD12 ' A' ' 38' ' ' ILE . . . -76.88 -43.49 35.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.062 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.402 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.1 ptt? -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.739 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.3 pt-20 -84.25 -43.95 14.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.049 0.452 . . . . 0.0 109.932 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.405 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 99.1 mttt -74.2 -21.02 59.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.503 ' HB2' HD11 ' A' ' 38' ' ' ILE . 2.3 m-85 -131.28 -172.24 2.79 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.701 0.286 . . . . 0.0 110.808 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -173.97 35.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.807 0.337 . . . . 0.0 111.122 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.692 HD12 ' OD2' ' A' ' 37' ' ' ASP . 31.2 mt -99.41 -18.07 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 67.45 11.86 8.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.305 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -129.07 -54.44 1.2 Allowed 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' HD12 ' A' ' 34' ' ' ILE . 26.7 m-20 -58.7 -23.03 58.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 32' ' ' TYR . 44.3 mm -61.37 -58.55 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.359 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.654 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -62.55 -21.21 65.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.937 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -81.81 -41.57 20.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.985 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -70.15 -22.82 62.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.809 0.338 . . . . 0.0 110.582 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.9 mt -82.31 -48.45 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 23.5 pttm -70.47 -33.75 71.62 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.842 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 59.1 mtpt -72.49 -38.42 68.16 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -61.71 -40.81 96.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 110.431 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.5 m-85 -81.51 -36.73 28.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.396 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -75.03 -26.62 59.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.664 0.269 . . . . 0.0 111.369 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -90.24 29.52 1.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.813 0.339 . . . . 0.0 111.212 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -155.0 -44.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.678 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -106.94 -4.89 18.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.461 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.449 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 74.0 m-80 63.53 162.33 0.12 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-O 120.647 0.261 . . . . 0.0 111.122 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HB3' HG22 ' A' ' 53' ' ' THR . 79.6 Cg_exo -46.32 173.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.826 2.351 . . . . 0.0 112.38 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.541 HG22 ' HB3' ' A' ' 52' ' ' PRO . 66.7 p -119.24 115.08 23.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.232 0.613 . . . . 0.0 110.629 -0.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.66 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 1.1 m95 -114.62 -174.13 2.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.136 0.493 . . . . 0.0 110.932 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.439 ' CD2' ' O ' ' A' ' 54' ' ' TRP . 26.5 m170 -163.45 61.8 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.202 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -53.52 137.88 35.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.402 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.814 ' O ' HG23 ' A' ' 83' ' ' ILE . 28.8 mm -115.59 149.84 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.343 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.654 HG21 ' HB2' ' A' ' 39' ' ' ALA . 47.7 t -141.34 53.83 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.132 0.491 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -155.06 -67.3 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.72 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.961 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -177.23 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.681 0.276 . . . . 0.0 111.351 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.408 ' N ' ' HG2' ' A' ' 60' ' ' ARG . 39.1 p-10 -172.5 18.54 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.669 ' CE1' HG23 ' A' ' 57' ' ' ILE . 39.4 p90 -59.89 -33.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.431 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.76 -58.21 5.45 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.337 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.422 ' O ' ' CD1' ' A' ' 65' ' ' TYR . 81.2 p 51.41 75.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD1' ' O ' ' A' ' 64' ' ' SER . 23.1 m-85 -143.1 29.72 1.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.214 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.623 HG21 ' OH ' ' A' ' 75' ' ' TYR . 47.7 t -58.73 -62.08 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.701 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.405 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 86.6 m -55.52 -31.7 62.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.83 0.347 . . . . 0.0 110.949 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 88' ' ' SER . 1.0 OUTLIER -77.13 -5.52 49.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.066 178.892 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 89.3 mt-10 -160.47 50.58 0.28 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 66' ' ' VAL . 98.9 m -86.48 -9.05 57.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.579 ' HA ' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -45.28 -24.66 0.3 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.718 0.294 . . . . 0.0 111.744 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -171.91 99.92 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.109 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.541 ' O ' ' HB2' ' A' ' 13' ' ' MET . 2.1 p90 -113.97 166.55 11.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.502 . . . . 0.0 111.761 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.872 HD11 ' HA ' ' A' ' 18' ' ' GLN . 8.2 tt -158.79 123.71 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.001 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.878 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 m-30 -111.18 139.31 46.67 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.516 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.8 p90 -170.47 132.37 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.025 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.606 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 2.5 p90 -126.43 154.31 43.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.737 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 6' ' ' ALA . 81.5 mt -115.58 103.13 10.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.519 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.26 -86.67 0.4 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.485 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.63 -11.79 7.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.7 t -95.59 120.15 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.718 0.294 . . . . 0.0 110.778 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.961 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -98.48 129.0 45.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 111.758 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 57' ' ' ILE . 69.3 mt -109.34 131.39 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.014 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 83' ' ' ILE . 6.4 mp -127.88 107.79 10.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.646 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 46' ' ' PHE . 67.0 tp -106.91 133.81 51.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.405 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.516 ' HB3' ' HA ' ' A' ' 73' ' ' PHE . 10.6 p90 -169.72 157.09 6.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.087 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.66 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -144.99 157.67 44.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.281 0.563 . . . . 0.0 111.795 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.514 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 41.9 t -87.61 179.49 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.2 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.332 -1.26 . . . . 0.0 112.451 179.692 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.715 0.293 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.488 ' HB ' ' CZ ' ' A' ' 77' ' ' TYR . 43.7 t -131.72 149.18 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.134 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.831 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.8 mp -108.0 138.05 36.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.106 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 27.5 mtpp -96.92 29.4 3.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.11 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.649 ' H ' HG22 ' A' ' 8' ' ' ILE . 50.2 t-20 88.97 85.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.576 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.555 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -98.81 165.75 11.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.184 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.1 t70 -148.93 21.57 0.99 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.555 ' O ' ' HG2' ' A' ' 13' ' ' MET . 47.3 ttm -94.54 42.27 1.09 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 16' ' ' ASP . 50.0 m 68.19 111.94 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.853 0.359 . . . . 0.0 110.321 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.438 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 8.6 mp0 -33.69 -34.62 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.194 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 14' ' ' SER . 7.5 t70 -55.82 -45.22 78.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.863 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.552 ' HE1' ' CZ ' ' A' ' 50' ' ' TYR . 23.4 mmt -69.96 -22.14 63.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.757 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.826 ' HA ' HD11 ' A' ' 74' ' ' ILE . 0.7 OUTLIER -68.78 -39.57 80.14 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.189 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.62 -38.61 54.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.823 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -72.8 -54.41 8.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.433 . . . . 0.0 110.535 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.23 -49.86 70.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.284 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 18' ' ' GLN . 77.8 t -57.86 -54.66 28.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.199 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.549 ' O ' HG22 ' A' ' 26' ' ' THR . 63.2 m-20 -66.78 -26.13 66.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.805 0.336 . . . . 0.0 110.746 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 49.3 t -73.05 -29.09 62.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 78' ' ' LEU . . . -77.67 -31.83 52.79 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.346 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 23' ' ' ASP . 3.9 t -78.48 -48.73 14.75 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.155 -0.684 . . . . 0.0 109.155 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' N ' ' CG2' ' A' ' 26' ' ' THR . 11.6 mm100 -64.42 -25.6 68.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.125 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -74.96 -44.63 47.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.977 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.599 ' HE3' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -75.91 -24.07 55.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.22 -179.786 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.599 ' HG3' ' HE3' ' A' ' 29' ' ' MET . 96.5 mt-10 -77.51 -55.84 5.04 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.984 0.421 . . . . 0.0 110.021 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.81 -25.17 67.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.762 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -141.18 135.05 30.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -102.28 26.1 8.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.319 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 35' ' ' GLU . 5.6 mm -98.55 177.14 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 34' ' ' ILE . 56.2 mt-10 -115.22 0.22 13.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.662 0.268 . . . . 0.0 110.935 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 8.0 mtpm? -111.27 -47.69 3.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.272 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -59.71 -26.21 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 39.8 mm -63.85 -58.97 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.341 179.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -19.84 64.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.0 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -78.9 -43.12 25.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.98 -28.26 66.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.003 0.43 . . . . 0.0 110.015 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.4 mt -82.59 -46.59 19.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.485 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -67.88 -30.77 70.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.169 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 45.3 mmtm -79.03 -40.26 31.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.78 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.5 -42.38 87.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.031 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -82.0 -45.43 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.763 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -25.67 65.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.469 ' NZ ' ' HB2' ' A' ' 48' ' ' LYS . 4.7 ttmp? -71.06 -21.27 62.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.615 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -125.13 -4.44 7.42 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.552 ' CZ ' ' HE1' ' A' ' 17' ' ' MET . 2.8 m-85 -130.19 4.98 4.84 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.89 156.78 0.1 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 111.146 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.431 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.7 Cg_endo -60.49 174.66 1.46 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.545 2.163 . . . . 0.0 112.089 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.431 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 9.0 t -122.26 125.21 45.54 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.132 0.573 . . . . 0.0 110.884 0.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.0 m95 -117.27 -171.61 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -174.31 72.64 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.998 0.427 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.844 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -59.43 128.85 39.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.836 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.823 ' O ' HG23 ' A' ' 83' ' ' ILE . 33.3 mm -98.5 147.22 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 58' ' ' VAL . 49.1 t -127.98 65.16 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.821 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.794 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.11 -97.15 0.11 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -123.6 -83.75 0.65 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.656 0.265 . . . . 0.0 110.922 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -152.34 10.96 0.52 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.818 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.605 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 23.2 p90 -49.24 -24.1 1.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -177.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.85 44.64 1.33 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.456 -0.878 . . . . 0.0 113.068 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.6 m -93.59 62.13 3.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -109.75 29.79 7.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.164 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.549 HG11 ' N ' ' A' ' 87' ' ' LYS . 47.6 t -118.37 -22.59 4.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.549 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.9 m -48.45 -27.69 2.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -45.7 -28.25 0.98 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.5 mm-40 -108.55 -67.51 0.97 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.219 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.466 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 11.4 m 80.47 0.6 1.92 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.901 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HG3' ' CE1' ' A' ' 72' ' ' HIS . 21.9 tptm -47.1 -28.52 1.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.196 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.506 ' CE1' ' HG3' ' A' ' 71' ' ' LYS . 67.0 m80 -157.05 93.94 1.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.395 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.568 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -120.98 152.28 38.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.235 -179.383 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.826 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -152.42 120.5 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.217 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.831 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.6 m-85 -107.68 139.26 42.5 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.921 0.391 . . . . 0.0 111.376 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 1.5 p90 -170.28 122.22 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.489 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.567 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 4.8 p90 -104.99 144.7 31.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.062 0.458 . . . . 0.0 111.526 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.417 HD11 ' CB ' ' A' ' 25' ' ' ALA . 71.3 mt -111.98 110.98 21.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.422 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -76.58 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.422 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.02 25.7 0.91 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 0.0 111.035 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.794 HG13 ' HA2' ' A' ' 59' ' ' GLY . 53.3 t -133.26 100.87 3.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.031 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.567 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -69.76 127.27 32.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.607 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.823 HG23 ' O ' ' A' ' 57' ' ' ILE . 62.5 mt -104.04 138.53 28.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.553 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.598 HD12 ' O ' ' A' ' 83' ' ' ILE . 11.0 mp -128.09 103.66 7.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.019 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.844 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.1 tp -108.31 113.31 26.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.517 ' CB ' HG11 ' A' ' 66' ' ' VAL . 9.0 m-85 -127.14 -179.19 4.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 111.565 -178.459 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.549 ' N ' HG11 ' A' ' 66' ' ' VAL . 1.5 tmtp? -151.87 98.47 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.069 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.494 ' N ' HG13 ' A' ' 66' ' ' VAL . 48.0 t -73.17 81.05 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.829 0.347 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.463 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.764 0.316 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 8' ' ' ILE . 26.6 t -153.76 163.91 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.243 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.623 HD13 ' HG3' ' A' ' 18' ' ' GLN . 58.8 mt -114.69 115.31 49.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.343 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -70.07 -41.26 74.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.272 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 179.66 74.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 0.0 110.679 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -79.18 142.63 36.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.482 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 8.8 t70 -146.78 23.55 1.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.68 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.498 ' HE2' ' O ' ' A' ' 72' ' ' HIS . 27.4 ttm -107.9 47.58 0.89 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.076 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.479 ' HB3' ' O ' ' A' ' 13' ' ' MET . 33.2 t 74.37 114.82 0.06 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.617 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 16.6 pt-20 -32.56 -35.67 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.666 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 14' ' ' SER . 65.9 t0 -54.55 -37.57 65.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.858 0.361 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.443 ' HB3' HD12 ' A' ' 74' ' ' ILE . 1.0 OUTLIER -74.71 -19.82 60.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.923 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -70.76 -45.06 65.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.826 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -78.75 -32.95 46.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.582 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.436 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.9 t70 -72.09 -46.62 56.05 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.431 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -61.08 -41.61 96.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.636 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 18' ' ' GLN . 76.6 t -57.69 -58.46 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-O 120.716 0.293 . . . . 0.0 110.587 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 55.9 m-20 -66.13 -30.39 70.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.187 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.686 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -68.67 -33.9 74.78 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.92 -25.38 37.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.678 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.6 m -74.86 -49.86 19.02 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.782 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 23' ' ' ASP . 9.1 mp0 -73.53 -24.38 60.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.613 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -68.84 -45.73 70.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.905 0.383 . . . . 0.0 110.255 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.558 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.0 mmt -79.53 -19.7 48.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.784 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -79.3 -46.45 17.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.542 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -81.07 -18.28 47.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.316 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -149.84 167.09 27.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.811 0.339 . . . . 0.0 111.35 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -156.54 45.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.993 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.524 HG21 ' OD1' ' A' ' 37' ' ' ASP . 30.2 mt -99.65 -7.06 9.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.391 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.9 mt-10 76.44 -56.07 0.57 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.954 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.488 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 7.9 mtpm? -76.76 -53.66 7.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.578 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.524 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.6 -26.81 45.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.223 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.613 HG23 ' HB1' ' A' ' 28' ' ' ALA . 48.3 mm -61.27 -52.32 62.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.279 179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.11 -26.59 62.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.047 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -77.45 -42.91 34.24 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.96 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.429 ' CE1' ' OE2' ' A' ' 45' ' ' GLU . 5.1 t80 -68.88 -31.14 69.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.069 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.686 HG23 ' SG ' ' A' ' 24' ' ' CYS . 97.2 mt -76.62 -50.65 21.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.744 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 17.9 ptpt -63.63 -35.19 79.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.514 ' C ' ' HD3' ' A' ' 44' ' ' LYS . 0.9 OUTLIER -56.41 -52.57 64.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.623 179.271 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.429 ' OE2' ' CE1' ' A' ' 41' ' ' TYR . 94.3 mt-10 -58.15 -48.68 79.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.675 0.274 . . . . 0.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.559 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -64.97 -21.13 66.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.617 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 41.8 m-20 -80.33 -34.36 36.75 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.687 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 7.7 mmpt? -90.13 13.95 13.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.541 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 6.7 ttpm? -119.43 -6.75 10.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.484 0.183 . . . . 0.0 111.329 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.452 ' CE2' ' HE2' ' A' ' 49' ' ' LYS . 51.2 m-85 -148.61 -79.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 111.07 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -177.98 135.77 0.35 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.716 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.31 169.27 22.02 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.425 2.083 . . . . 0.0 112.445 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.9 m -114.32 127.85 56.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.982 0.513 . . . . 0.0 110.844 0.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.455 ' CD1' ' OD1' ' A' ' 47' ' ' ASP . 7.9 m95 -89.02 176.06 7.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.053 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.435 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 19.9 t-80 -155.4 103.97 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.952 0.406 . . . . 0.0 110.841 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.774 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.1 t -93.83 147.37 23.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.066 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.501 HG23 ' CE1' ' A' ' 62' ' ' PHE . 6.9 mm -117.46 162.41 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.66 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.408 ' N ' HG22 ' A' ' 57' ' ' ILE . 59.1 t -147.19 87.51 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.052 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.66 -87.5 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.488 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 77.9 mtt-85 -157.99 66.54 0.47 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.946 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.465 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER 49.46 15.67 0.14 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.252 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.501 ' CE1' HG23 ' A' ' 57' ' ' ILE . 6.3 p90 -59.68 -19.03 46.9 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.521 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -54.4 -51.26 52.67 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.903 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.1 m 49.34 70.18 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.877 0.37 . . . . 0.0 110.583 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.488 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 1.6 t80 -149.65 50.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.149 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.541 ' O ' HG12 ' A' ' 66' ' ' VAL . 39.4 t -119.67 -0.88 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.069 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -107.21 -29.05 9.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.715 0.293 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.516 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 41.1 m80 -49.09 -27.47 3.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.816 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 14.4 pt-20 153.52 49.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.59 0.556 . . . . 0.0 110.9 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 44.8 m -103.1 -86.79 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.317 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 75.35 -13.86 0.82 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.65 -179.501 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.498 ' O ' ' HE2' ' A' ' 13' ' ' MET . 2.9 m-70 -123.29 81.17 1.86 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 5.7 p90 -114.29 170.95 7.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.716 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.526 HG13 ' HB1' ' A' ' 11' ' ' ALA . 7.5 tt -147.18 108.42 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.579 178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.6 ' CD1' HD13 ' A' ' 84' ' ' LEU . 7.6 m-30 -76.64 149.87 36.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.487 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HB3' ' HB ' ' A' ' 83' ' ' ILE . 3.2 t80 -150.53 135.42 17.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.217 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 51.9 t80 -125.89 127.76 46.52 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.757 0.313 . . . . 0.0 111.459 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.651 HD12 ' N ' ' A' ' 78' ' ' LEU . 0.7 OUTLIER -126.57 109.79 12.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.795 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.41 -88.1 0.01 OUTLIER Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.768 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -129.61 21.42 5.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 111.021 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.52 HG12 ' N ' ' A' ' 82' ' ' ALA . 53.8 t -128.16 160.76 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.737 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.52 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -130.11 115.04 16.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.785 0.326 . . . . 0.0 111.303 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.581 ' HB ' ' HB3' ' A' ' 76' ' ' PHE . 68.5 mt -95.16 125.01 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.6 HD13 ' CD1' ' A' ' 75' ' ' TYR . 52.0 tp -119.87 107.28 12.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.704 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.774 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.6 tp -106.87 150.44 26.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.941 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.488 ' CE2' ' O ' ' A' ' 65' ' ' TYR . 17.9 p90 -174.62 178.27 1.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.07 0.462 . . . . 0.0 111.508 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.462 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 5.8 tmtm? -132.76 88.87 2.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.336 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 43.3 t -73.15 69.24 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.581 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.59 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' HB1' HG11 ' A' ' 22' ' ' VAL . . . . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.829 0.347 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.7 t -130.79 135.34 60.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.839 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.766 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.9 mp -104.19 96.93 4.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 27.6 mtpp -60.99 -18.58 58.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 43.7 t30 172.66 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.994 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.512 ' HB3' ' CD ' ' A' ' 18' ' ' GLN . . . -156.5 138.59 14.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.008 0.433 . . . . 0.0 111.664 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.455 ' HB3' ' CE1' ' A' ' 73' ' ' PHE . 38.5 t70 -133.91 12.21 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.768 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 47.8 ttm -90.7 34.34 0.9 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.22 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.47 ' O ' ' N ' ' A' ' 16' ' ' ASP . 38.6 t 68.4 112.02 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.51 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.4 mt-10 -27.58 -39.08 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.563 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 14' ' ' SER . 1.5 m-20 -51.32 -45.64 62.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.355 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.494 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.6 mpt? -70.76 -23.24 62.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.144 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.932 ' HA ' HD11 ' A' ' 74' ' ' ILE . 63.0 mt-30 -70.8 -37.87 73.31 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -80.52 -34.57 35.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.68 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -74.93 -50.88 15.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.071 0.462 . . . . 0.0 110.404 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.5 65.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.195 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.606 HG23 ' O ' ' A' ' 18' ' ' GLN . 96.5 t -58.65 -47.67 88.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.614 0.245 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 36.5 t70 -66.63 -35.19 79.58 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.628 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.0 t -68.12 -35.2 77.75 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -77.62 -24.9 49.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.725 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -75.97 -52.89 9.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.875 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 23.5 pt20 -66.95 -26.15 66.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.969 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -65.67 -56.44 12.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.508 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.3 ptp -69.28 -18.6 63.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -82.47 -47.82 11.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.245 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -72.86 -27.96 62.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.47 ' CD2' ' OD2' ' A' ' 37' ' ' ASP . 13.1 m-85 -119.24 -170.88 2.01 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.453 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -147.67 27.94 0.97 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.795 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.562 HG22 ' H ' ' A' ' 35' ' ' GLU . 7.1 mt -121.21 170.7 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.562 ' H ' HG22 ' A' ' 34' ' ' ILE . 24.5 pt-20 -114.48 23.79 12.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.779 0.323 . . . . 0.0 110.977 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -124.68 -49.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.578 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.514 ' OD1' ' HB ' ' A' ' 34' ' ' ILE . 9.4 p-10 -64.09 -27.37 69.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.537 ' O ' HD13 ' A' ' 42' ' ' ILE . 34.3 mm -61.35 -57.04 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.649 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.62 -28.83 61.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.28 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -76.96 -35.14 57.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 50.8 t80 -69.38 -30.35 68.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.78 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.537 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.1 mp -84.28 -43.51 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -66.29 -31.95 73.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.939 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 73.2 mmtt -83.45 -39.45 20.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.92 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 17.5 tp10 -54.04 -47.29 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.961 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.499 ' CD2' HD21 ' A' ' 85' ' ' LEU . 56.1 m-85 -80.05 -44.41 20.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.221 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -67.0 -9.81 42.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.75 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 44' ' ' LYS . 4.1 tppp? -81.65 -27.62 34.01 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.97 41.44 0.83 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.425 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 9.1 m-85 -132.78 -86.63 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.567 0.223 . . . . 0.0 111.022 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.59 104.78 0.16 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.515 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 31.3 Cg_exo -57.46 160.28 14.32 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.195 1.93 . . . . 0.0 111.996 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.8 m -112.38 142.52 44.82 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.303 0.641 . . . . 0.0 110.621 -0.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.475 ' HB3' HD11 ' A' ' 85' ' ' LEU . 19.5 m95 -111.08 138.2 47.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.839 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 52.8 m170 -122.03 98.15 5.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.065 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HB2' HD13 ' A' ' 85' ' ' LEU . 54.0 t -82.04 142.32 32.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.568 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.853 ' O ' HG23 ' A' ' 83' ' ' ILE . 16.5 mm -117.75 142.92 29.85 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-O 120.842 0.354 . . . . 0.0 111.773 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.737 ' O ' HG13 ' A' ' 58' ' ' VAL . 12.3 p -127.71 94.57 2.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.394 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.495 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 168.19 -94.43 0.11 Allowed Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.947 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -125.22 -85.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.574 0.225 . . . . 0.0 111.604 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -146.41 13.81 1.24 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.525 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 21.2 p90 -70.94 52.03 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 111.054 -177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.647 ' HA3' HD11 ' A' ' 84' ' ' LEU . . . -78.69 -62.0 2.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.419 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' CG ' ' A' ' 65' ' ' TYR . 21.3 m 79.58 116.58 0.06 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.565 ' CG ' ' O ' ' A' ' 64' ' ' SER . 36.1 p90 53.39 64.26 1.92 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.738 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 86' ' ' PHE . 51.8 t -94.4 -24.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.626 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 71' ' ' LYS . 87.2 m -134.82 -32.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.671 0.272 . . . . 0.0 111.555 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.72 -5.93 18.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.53 ' HG2' ' N ' ' A' ' 70' ' ' THR . 13.8 pm0 -91.01 -50.86 5.63 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.555 ' O ' ' CB ' ' A' ' 71' ' ' LYS . 4.5 t -134.4 -44.67 0.76 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.559 ' HD2' HG22 ' A' ' 67' ' ' THR . 14.2 mmmm 108.69 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.394 1.059 . . . . 0.0 110.017 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.499 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 43.8 m80 -128.54 79.21 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.581 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.627 ' O ' ' HB2' ' A' ' 13' ' ' MET . 11.0 p90 -118.7 171.64 8.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.932 HD11 ' HA ' ' A' ' 18' ' ' GLN . 12.4 tt -168.07 111.0 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.094 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.565 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.7 m-85 -97.22 154.58 17.3 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.035 0.445 . . . . 0.0 111.576 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 15.0 p90 -170.37 123.67 0.69 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.724 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -88.18 125.77 34.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.592 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.545 HD21 HG13 ' A' ' 22' ' ' VAL . 86.6 mt -123.17 132.87 54.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.218 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.99 -100.0 0.06 OUTLIER Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.792 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 pm0 -133.49 23.84 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.712 0.291 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.495 HG13 ' HA2' ' A' ' 59' ' ' GLY . 46.9 t -140.64 137.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -90.9 128.66 36.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.077 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 57' ' ' ILE . 73.6 mt -118.85 137.44 52.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.516 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.647 HD11 ' HA3' ' A' ' 63' ' ' GLY . 0.7 OUTLIER -135.09 113.66 11.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.103 0.478 . . . . 0.0 111.47 179.622 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 56' ' ' CYS . 45.8 tp -98.99 141.05 32.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.67 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.725 ' HB3' HG13 ' A' ' 66' ' ' VAL . 8.0 p90 -156.44 139.86 15.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.448 0.642 . . . . 0.0 111.616 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.567 ' HD3' ' N ' ' A' ' 88' ' ' SER . 1.6 tmtp? -94.32 154.2 17.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.435 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.567 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 8.6 m -127.95 148.44 50.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.845 0.355 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.489 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.875 0.369 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.587 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 0.4 OUTLIER -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.441 ' N ' ' HG3' ' A' ' 60' ' ' ARG . 35.5 p-10 -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.782 0.325 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -144.46 81.38 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.138 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.594 HG21 ' HB2' ' A' ' 11' ' ' ALA . 61.1 mt -60.75 116.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.969 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -71.95 -44.39 63.66 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.634 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 43.9 t30 -153.71 116.98 4.58 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.902 0.382 . . . . 0.0 110.941 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -103.73 84.0 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.463 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 59.5 t0 -81.1 -5.21 57.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.971 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.459 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.7 tpp -92.99 162.64 13.97 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.58 0.229 . . . . 0.0 110.444 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 13' ' ' MET . 62.9 m -40.07 -74.56 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.968 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' SER . 39.6 tt0 177.71 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.527 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.515 ' HB2' ' HE1' ' A' ' 17' ' ' MET . 59.8 m-20 -56.85 -33.08 66.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.099 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.516 ' HB3' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -75.59 -26.77 58.15 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.672 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.794 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.9 mt-30 -66.33 -46.07 78.09 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -79.92 -32.55 40.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.94 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.503 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.4 t0 -72.67 -50.06 27.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB1' ' CE1' ' A' ' 76' ' ' PHE . . . -58.82 -48.83 79.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.081 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 18' ' ' GLN . 90.9 t -55.23 -53.12 38.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.917 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -71.84 -24.5 61.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.834 0.35 . . . . 0.0 110.653 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 39.1 t -72.87 -32.8 65.65 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.07 -27.55 39.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.894 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.7 m -78.2 -45.83 22.03 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 87.3 mt-30 -71.98 -24.92 61.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.355 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.827 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -76.0 -41.78 50.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.177 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -74.93 -29.82 61.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.688 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.544 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.4 pt-20 -82.38 -43.04 17.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.982 0.42 . . . . 0.0 110.135 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' O ' ' CD1' ' A' ' 32' ' ' TYR . 62.8 tttp -76.31 -21.35 56.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.743 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.425 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 54.7 m-85 -152.51 161.1 43.05 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.979 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -144.5 18.57 1.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.6 mm -75.77 -13.78 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.379 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 87.2 mt-10 74.94 -54.02 0.67 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.823 0.344 . . . . 0.0 110.772 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.406 ' NZ ' HG22 ' A' ' 34' ' ' ILE . 33.3 mtmm -69.75 -57.96 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.51 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.86 -27.22 17.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.305 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.827 HG23 ' HB1' ' A' ' 28' ' ' ALA . 49.3 mm -61.31 -54.22 38.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.438 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.14 -27.12 63.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -80.73 -38.78 28.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.762 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -70.42 -27.6 64.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.358 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.44 HG12 ' SG ' ' A' ' 24' ' ' CYS . 86.9 mt -79.55 -47.69 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.562 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -65.29 -38.45 90.26 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.4 tptm -57.02 -57.29 13.2 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.126 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -55.13 -51.24 67.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.225 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.49 ' CE2' HD22 ' A' ' 85' ' ' LEU . 39.8 m-85 -62.67 -25.38 68.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.713 0.292 . . . . 0.0 111.115 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -86.45 -25.99 24.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.158 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -89.9 -17.53 27.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.429 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -101.84 -61.14 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.701 0.286 . . . . 0.0 111.353 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -91.71 14.7 14.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.627 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.405 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 75.1 m-20 59.79 157.14 0.1 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.679 0.276 . . . . 0.0 110.94 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 51' ' ' ASN . 15.2 Cg_endo -57.3 172.63 0.86 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.533 2.155 . . . . 0.0 112.066 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 53' ' ' THR . 9.5 t -122.82 103.41 8.62 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.077 0.551 . . . . 0.0 110.819 0.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.682 ' HB3' HD11 ' A' ' 85' ' ' LEU . 4.5 m95 -102.12 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.486 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 78.1 t60 178.17 75.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.238 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.623 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.2 t -64.21 148.25 50.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.396 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.5 mm -114.68 146.18 19.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.604 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -133.23 77.22 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.769 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.524 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 177.76 -81.2 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.521 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 55.9 mtp85 -142.72 -80.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.748 0.309 . . . . 0.0 111.288 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.0 p-10 -156.3 14.43 0.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.761 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.76 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -51.66 -25.67 7.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.341 . . . . 0.0 111.263 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.34 51.96 0.84 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.023 -0.608 . . . . 0.0 111.728 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.0 p -85.78 60.48 6.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.057 0.456 . . . . 0.0 111.178 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 13.8 m-85 -89.47 30.7 0.98 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.685 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 73' ' ' PHE . 66.3 t -46.84 -77.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.9 m -53.08 -30.55 36.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.522 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -56.78 -20.98 25.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.866 0.365 . . . . 0.0 110.258 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.618 ' HG3' ' HB2' ' A' ' 88' ' ' SER . 0.3 OUTLIER -82.39 -73.62 0.39 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.357 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.843 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.5 t -175.61 -86.64 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.406 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.843 ' H ' HG23 ' A' ' 70' ' ' THR . 13.9 tptt -163.47 26.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.992 0.425 . . . . 0.0 110.373 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -122.88 75.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.585 ' HB3' HG13 ' A' ' 66' ' ' VAL . 9.3 p90 -119.23 -176.25 3.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.192 0.52 . . . . 0.0 111.858 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.516 HG21 ' HB3' ' A' ' 17' ' ' MET . 7.9 tt 177.68 111.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.421 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.634 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 9.3 p90 -123.99 147.93 47.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.289 0.566 . . . . 0.0 111.986 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.6 ' HE2' HD11 ' A' ' 78' ' ' LEU . 2.0 p90 -140.37 170.14 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.846 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.4 ' O ' HD23 ' A' ' 78' ' ' LEU . 3.1 t80 -121.21 137.72 54.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.726 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.6 HD11 ' HE2' ' A' ' 76' ' ' PHE . 84.3 mt -131.36 130.88 43.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.116 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.7 -92.09 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.806 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.523 ' OE1' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -138.46 33.82 2.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.996 0.426 . . . . 0.0 110.94 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.524 HG13 ' HA2' ' A' ' 59' ' ' GLY . 87.8 t -138.38 150.59 24.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.556 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.92 118.68 36.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.123 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.817 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.5 mp -105.07 132.97 50.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -137.61 124.51 21.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.104 0.478 . . . . 0.0 111.487 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.682 HD11 ' HB3' ' A' ' 54' ' ' TRP . 33.2 tp -119.74 137.47 53.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.876 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 2.8 p90 -137.68 152.65 49.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.181 0.515 . . . . 0.0 111.965 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.537 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 6.4 tmtm? -124.94 127.93 47.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.155 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.802 ' HA ' HG22 ' A' ' 70' ' ' THR . 29.0 t -96.22 151.3 19.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.623 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.554 179.791 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.439 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.776 0.322 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 44.3 t -134.04 105.34 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.43 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.702 HD13 ' HG3' ' A' ' 18' ' ' GLN . 67.6 mt -82.58 113.94 22.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.955 0.407 . . . . 0.0 110.585 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -78.8 -34.3 45.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.955 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -169.88 110.73 0.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -125.3 137.32 54.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.974 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -140.88 2.03 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.51 ' O ' ' HG2' ' A' ' 13' ' ' MET . 50.2 ttp -94.19 58.87 2.56 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.781 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.9 t 64.18 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.02 0.438 . . . . 0.0 111.283 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.538 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -35.08 -34.51 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.853 179.615 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -50.9 -39.19 53.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.853 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.414 ' HG2' ' CE ' ' A' ' 13' ' ' MET . 0.9 OUTLIER -68.77 -25.31 64.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.245 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.702 ' HG3' HD13 ' A' ' 8' ' ' ILE . 2.8 mp0 -68.57 -42.91 77.62 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.068 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -79.05 -32.07 44.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.393 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -77.11 -50.19 13.59 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.896 0.379 . . . . 0.0 110.636 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.78 80.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.874 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -63.07 -41.05 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.726 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -68.11 -39.68 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 81.1 m -67.71 -32.78 73.66 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -78.29 -25.55 46.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.469 177.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 99.0 m -74.97 -55.24 5.97 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -65.36 -26.63 68.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.212 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.523 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -67.54 -46.55 72.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.613 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.52 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 1.6 tpt -70.06 -27.02 64.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.749 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -83.31 -43.22 16.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.027 0.442 . . . . 0.0 110.125 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -77.86 -22.54 49.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.919 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -133.79 150.05 51.43 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.741 0.305 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -116.37 29.83 7.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.022 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.711 HG22 ' H ' ' A' ' 35' ' ' GLU . 4.9 mt -123.55 176.35 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.711 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.2 mt-10 -109.18 14.73 23.7 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.775 0.321 . . . . 0.0 110.786 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.551 ' HA ' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -113.99 -58.9 2.09 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.288 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -53.52 -25.76 18.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.903 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.523 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 40.4 mm -64.0 -59.94 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.465 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.457 ' HB2' ' HB ' ' A' ' 58' ' ' VAL . . . -58.05 -29.91 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.97 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.524 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -71.69 -42.78 67.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.376 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 5.5 t80 -66.78 -27.8 67.88 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.92 0.391 . . . . 0.0 110.256 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -79.06 -50.39 18.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.184 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.524 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.2 pttm -71.23 -27.78 63.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.407 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 55.9 mtpt -71.26 -48.12 52.96 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.648 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -61.39 -37.56 83.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.734 0.302 . . . . 0.0 110.818 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.586 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.7 m-85 -83.29 -19.54 36.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.755 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.4 -36.72 16.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.72 0.295 . . . . 0.0 111.395 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 4.0 mptp? -90.27 29.21 1.28 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.363 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -145.86 -44.37 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -104.79 5.79 33.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.45 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 61.61 154.0 0.11 Allowed Pre-proline 0 C--N 1.333 -0.141 0 CA-C-O 120.766 0.317 . . . . 0.0 110.886 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 50.9 Cg_exo -54.01 174.77 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.579 2.186 . . . . 0.0 112.173 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.9 m -126.84 97.22 4.9 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 123.118 0.567 . . . . 0.0 110.455 -0.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.632 ' HB2' ' O ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -150.9 -179.08 6.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.889 -179.733 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.646 ' O ' HD12 ' A' ' 85' ' ' LEU . 19.8 p-80 -179.51 -179.63 0.54 Allowed 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 120.935 0.397 . . . . 0.0 111.043 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 31.9 p -116.91 153.33 32.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.357 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.688 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.4 mm -94.38 147.63 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.294 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.712 ' O ' HG13 ' A' ' 58' ' ' VAL . 11.4 p -122.19 72.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.534 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.77 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.52 -78.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.376 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -149.79 -82.09 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.7 0.286 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -155.5 13.02 0.35 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.775 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.615 ' CE1' HG23 ' A' ' 57' ' ' ILE . 4.1 p90 -55.97 -20.29 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -129.14 50.04 0.9 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.732 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.5 m -50.11 -87.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.79 -0.241 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 58.38 61.46 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.004 0.431 . . . . 0.0 110.72 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 66' ' ' VAL . 43.8 t -116.64 -0.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.838 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -111.37 -28.1 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.777 0.322 . . . . 0.0 111.172 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.586 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 39.6 m80 -48.37 -27.73 2.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.178 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.586 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 16.6 pt-20 155.22 45.85 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.819 0.447 . . . . 0.0 110.735 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.57 HG21 HG13 ' A' ' 66' ' ' VAL . 22.9 m -92.31 -85.96 0.25 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.516 -179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 70' ' ' THR . 31.1 mmmt 76.12 -12.32 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.074 -179.022 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.492 ' H ' HG22 ' A' ' 70' ' ' THR . 19.9 m80 -132.89 81.45 1.94 Allowed 'General case' 0 C--O 1.23 0.076 0 CA-C-O 120.962 0.411 . . . . 0.0 110.25 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 13' ' ' MET . 17.7 p90 -115.47 -177.08 3.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.651 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.0 tt -168.55 123.24 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.05 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.906 ' CD1' HD23 ' A' ' 84' ' ' LEU . 61.4 m-85 -101.76 137.27 40.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 1.3 p90 -159.03 117.54 2.92 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.085 0.469 . . . . 0.0 111.281 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.448 ' O ' HD23 ' A' ' 78' ' ' LEU . 48.8 t80 -84.53 136.78 33.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.924 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.548 HD12 HD12 ' A' ' 83' ' ' ILE . 90.0 mt -136.58 123.68 21.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.922 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 54.05 -106.61 0.5 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.541 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.444 ' OE1' HG23 ' A' ' 81' ' ' VAL . 1.6 pp0? -125.46 33.72 5.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 111.352 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.77 HG13 ' HA2' ' A' ' 59' ' ' GLY . 89.0 t -155.46 124.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.601 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.64 131.61 34.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.9 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.688 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.6 mt -110.02 138.72 36.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.532 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.906 HD23 ' CD1' ' A' ' 75' ' ' TYR . 2.8 tm? -135.75 115.59 13.06 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.927 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 55' ' ' HIS . 56.0 tp -96.91 136.84 36.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.605 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.632 ' O ' ' HB2' ' A' ' 54' ' ' TRP . 23.6 p90 -142.3 123.64 14.77 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.675 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 54' ' ' TRP . 1.6 tmtp? -84.96 69.3 10.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 47.6 t -76.75 63.66 2.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.539 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.849 0.357 . . . . 0.0 110.975 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.529 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 57.9 t -123.68 134.37 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.113 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.806 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.0 mp -112.35 101.05 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.177 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.477 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 33.3 mmtp -54.74 -23.14 16.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.87 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 45.1 t30 177.44 119.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.691 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.596 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -94.94 95.62 8.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.852 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.456 ' HB2' ' CE1' ' A' ' 73' ' ' PHE . 65.7 t0 -82.08 -33.31 29.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.153 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.533 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 50.9 tpp -78.01 162.22 26.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.713 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.424 ' N ' ' HG3' ' A' ' 13' ' ' MET . 43.0 t -39.67 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.126 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.44 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -178.5 -29.68 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.18 -34.58 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.739 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 24.0 mmt -74.9 -24.82 58.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.666 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 74' ' ' ILE . 3.2 mp0 -67.5 -45.14 76.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -81.04 -31.44 34.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.241 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 46' ' ' PHE . 10.2 t0 -77.03 -50.19 13.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.342 . . . . 0.0 110.681 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.771 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -65.57 -48.09 73.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.318 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 18' ' ' GLN . 88.7 t -62.44 -46.16 97.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 66.3 t0 -72.0 -34.87 69.22 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 121.138 -0.225 . . . . 0.0 110.702 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 48.9 t -68.9 -33.68 74.17 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.21 -27.08 53.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.523 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 92.7 m -74.96 -53.53 8.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.004 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 24.4 pt20 -68.32 -23.28 64.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.93 -47.82 56.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.915 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -72.21 -27.14 62.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.16 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -79.44 -46.25 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HG3' ' CE1' ' A' ' 32' ' ' TYR . 16.9 tppt? -82.37 -24.19 34.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.51 ' CE1' ' HG3' ' A' ' 31' ' ' LYS . 7.6 m-85 -134.77 156.24 49.2 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.844 0.354 . . . . 0.0 110.621 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -143.86 23.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.115 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.9 mm -78.07 -16.55 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.59 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 86.4 mt-10 76.71 -54.12 0.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -76.51 -50.32 14.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.357 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.407 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 66.3 t0 -56.14 -29.84 61.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.945 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.634 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.4 mm -58.01 -53.05 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.351 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.594 ' HB2' ' CG2' ' A' ' 58' ' ' VAL . . . -62.25 -24.16 67.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.947 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.14 -38.09 27.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -70.82 -24.42 62.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.536 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.429 HG21 ' SG ' ' A' ' 56' ' ' CYS . 79.6 mt -84.91 -46.27 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 43' ' ' LYS . 5.3 tmtm? -64.31 -37.71 88.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.686 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 12.2 tppt? -70.71 -56.49 6.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.436 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -49.44 -40.17 35.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.512 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.695 ' CE2' HD22 ' A' ' 85' ' ' LEU . 19.2 m-85 -68.37 -51.3 45.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.23 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -68.62 -9.82 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.455 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -59.67 -28.32 67.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.502 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -164.07 32.14 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 3.4 m-85 -125.85 10.65 7.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.621 0.248 . . . . 0.0 111.196 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 62.99 134.64 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.785 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HB2' ' HB ' ' A' ' 53' ' ' THR . 54.8 Cg_endo -70.11 166.89 26.53 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.329 2.019 . . . . 0.0 112.099 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' A' ' 52' ' ' PRO . 8.8 t -130.75 122.35 27.09 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.234 0.614 . . . . 0.0 110.638 -0.036 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 54' ' ' TRP . 6.1 m95 -100.12 160.3 14.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.256 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 39.5 m80 -131.58 62.38 1.63 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.449 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.4 t -55.53 106.95 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.834 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.789 ' O ' HG23 ' A' ' 83' ' ' ILE . 25.1 mm -82.29 153.93 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.819 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.594 ' CG2' ' HB2' ' A' ' 39' ' ' ALA . 60.6 t -141.15 68.07 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.93 0.395 . . . . 0.0 110.739 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -174.33 -76.93 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.574 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.9 mtp85 -149.84 -77.91 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.725 0.298 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -154.96 14.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.608 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.542 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 28.3 p90 -56.98 -16.31 6.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.13 51.58 0.85 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.507 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.654 ' O ' HG23 ' A' ' 66' ' ' VAL . 45.9 t -44.7 -76.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.316 . . . . 0.0 111.631 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 42.59 31.57 0.3 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.489 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.672 HG21 ' OH ' ' A' ' 75' ' ' TYR . 45.2 t -97.53 -2.84 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.8 m -114.01 -27.41 7.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.822 0.344 . . . . 0.0 111.09 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.577 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 25.5 t-80 -48.28 -27.86 2.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 15.5 pt-20 157.13 44.75 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.422 0.452 . . . . 0.0 111.396 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.748 HG22 ' H ' ' A' ' 72' ' ' HIS . 73.8 m -86.77 -81.89 0.22 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.333 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 70' ' ' THR . 46.7 mmtm 75.91 -3.73 2.51 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.649 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.748 ' H ' HG22 ' A' ' 70' ' ' THR . 0.3 OUTLIER -156.48 92.87 1.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.188 0.518 . . . . 0.0 110.716 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.502 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 8.3 p90 -122.62 -170.86 2.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.135 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.71 HD12 ' OE1' ' A' ' 18' ' ' GLN . 5.5 tt -162.42 110.94 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.567 178.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.806 ' O ' HG23 ' A' ' 8' ' ' ILE . 10.7 m-30 -99.51 140.12 34.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.457 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.771 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.1 p90 -170.17 127.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.101 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.529 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 8.3 p90 -114.47 145.98 41.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.212 0.53 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 6' ' ' ALA . 81.7 mt -115.58 117.59 30.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.495 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -77.31 0.2 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.413 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.56 24.93 0.87 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.1 t -134.14 118.5 28.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.873 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.515 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -92.04 122.78 34.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 112.063 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.789 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.3 mp -100.47 133.29 44.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.187 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.73 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.4 mp -120.1 97.99 5.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 111.569 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.695 HD22 ' CE2' ' A' ' 46' ' ' PHE . 49.8 tp -98.69 134.62 41.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.692 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.502 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 7.0 p90 -171.89 163.96 6.32 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.626 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HB3' ' NE2' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -113.77 81.21 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.609 179.109 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 89.3 p -69.02 67.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.843 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.34 -1.256 . . . . 0.0 112.52 179.889 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.875 0.369 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.587 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 0.4 OUTLIER -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.441 ' N ' ' HG3' ' A' ' 60' ' ' ARG . 35.5 p-10 -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.782 0.325 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.2 t -135.14 90.74 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.689 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -80.88 91.09 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 66.8 mttm -58.79 -20.09 46.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.541 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 19.9 t-20 173.47 129.66 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.675 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.45 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -146.62 128.74 15.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -131.73 2.91 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 55.8 ttp -96.47 62.57 2.05 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.934 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 t 64.56 110.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.44 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.511 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.0 mt-10 -40.45 -32.77 0.21 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.246 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -53.94 -35.07 61.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.403 ' HB2' HD12 ' A' ' 74' ' ' ILE . 26.2 mmt -70.91 -24.42 62.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 3.5 mp0 -71.04 -41.11 71.24 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -77.8 -33.41 52.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.751 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -76.3 -52.52 9.81 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 120.971 0.415 . . . . 0.0 110.668 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.85 -49.94 75.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' GLN . 94.4 t -60.37 -51.37 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.46 -29.28 69.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.74 0.305 . . . . 0.0 110.453 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 46.4 t -71.66 -32.3 67.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.44 -23.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.026 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.0 m -80.56 -44.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -74.45 -28.08 60.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.252 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -74.13 -50.18 20.54 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.4 tpt -68.46 -25.96 65.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.616 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -80.64 -47.22 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.065 0.459 . . . . 0.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -73.88 -25.03 59.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.678 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -144.28 152.27 40.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.818 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -136.93 46.22 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 33.7 mt -98.18 -16.69 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.432 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 46.1 mm-40 77.94 -54.84 0.51 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.864 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -74.42 -52.93 10.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -55.75 -29.36 59.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.28 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.423 HG23 ' HB1' ' A' ' 28' ' ' ALA . 47.5 mm -60.07 -50.05 81.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.713 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.6 -20.94 63.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.201 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -82.68 -40.52 20.56 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.832 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -70.76 -26.23 63.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.194 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 85.3 mt -83.41 -46.22 18.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 35.2 ttmt -63.81 -37.69 88.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.267 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 12.8 mmmm -75.23 -31.86 60.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -58.96 -58.89 6.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.72 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.441 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 46.5 m-85 -69.91 -30.71 68.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 62.7 t0 -64.65 -34.12 77.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.964 0.411 . . . . 0.0 110.96 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.551 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -90.27 30.43 1.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.816 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -152.75 -43.49 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.352 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.57 0.45 15.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.757 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 5.3 m120 62.71 156.82 0.12 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.711 0.291 . . . . 0.0 111.287 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.429 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 11.2 Cg_endo -54.49 173.52 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.862 2.375 . . . . 0.0 112.212 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.429 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 89.7 m -117.8 128.16 54.59 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.226 0.611 . . . . 0.0 110.463 -0.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.662 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 3.1 m95 -119.3 -168.67 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.053 0.454 . . . . 0.0 111.047 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -168.25 63.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.407 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.894 ' SG ' HD13 ' A' ' 85' ' ' LEU . 60.1 m -48.4 138.34 10.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.113 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.796 ' O ' HG23 ' A' ' 83' ' ' ILE . 20.0 mm -114.48 140.99 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.743 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.1 76.95 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.95 179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.74 -66.93 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.284 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.763 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 99.4 mtt180 -154.97 -80.9 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.741 0.305 . . . . 0.0 111.057 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.6 p-10 -160.92 17.88 0.12 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.324 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.684 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 25.1 p90 -52.8 -20.7 3.42 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 65' ' ' TYR . . . -58.52 -60.59 8.66 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.158 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p 49.6 26.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 13.8 m-30 -111.81 41.37 1.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.922 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.55 HG21 ' OH ' ' A' ' 75' ' ' TYR . 49.0 t -75.53 -71.34 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.815 0.34 . . . . 0.0 111.301 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.5 m -76.97 -28.65 55.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.219 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.401 ' ND1' ' O ' ' A' ' 68' ' ' HIS . 26.1 t-80 -54.63 -21.05 9.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.198 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 88' ' ' SER . 10.3 pt-20 -110.01 -55.23 2.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.478 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.645 HG22 ' N ' ' A' ' 71' ' ' LYS . 28.3 m -162.89 -101.71 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.074 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.645 ' N ' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 179.95 25.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.789 0.328 . . . . 0.0 111.383 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.457 ' O ' ' HA ' ' A' ' 86' ' ' PHE . 40.5 m80 -107.83 68.02 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.967 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 13' ' ' MET . 36.7 p90 -107.04 -174.99 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.216 0.532 . . . . 0.0 111.425 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.585 HG23 ' O ' ' A' ' 74' ' ' ILE . 12.2 tt -169.65 109.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.5 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.55 ' OH ' HG21 ' A' ' 66' ' ' VAL . 56.1 m-85 -89.83 138.85 31.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.762 0.315 . . . . 0.0 111.186 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.642 ' CZ ' HG22 ' A' ' 83' ' ' ILE . 1.9 p90 -166.39 112.13 0.83 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 0.0 110.824 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -91.88 129.36 37.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.3 mt -119.29 134.94 54.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 0.0 111.211 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.18 -103.92 0.14 Allowed Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.798 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.65 ' NE2' HG23 ' A' ' 81' ' ' VAL . 2.0 pp0? -128.12 33.04 4.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.921 0.391 . . . . 0.0 111.189 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.65 HG23 ' NE2' ' A' ' 80' ' ' GLN . 88.6 t -146.06 140.64 21.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.581 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.763 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -93.25 131.69 38.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.796 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.796 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.0 mt -127.4 132.54 69.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.455 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.655 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -144.78 127.38 16.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.056 0.455 . . . . 0.0 111.579 -179.442 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.894 HD13 ' SG ' ' A' ' 56' ' ' CYS . 29.8 tp -109.11 141.04 41.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.602 ' H ' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -157.97 154.73 28.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.003 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.662 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -140.41 154.18 46.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.013 0.435 . . . . 0.0 111.688 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 92.9 p -81.28 76.86 8.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.079 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.516 ' HA3' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.329 -1.262 . . . . 0.0 112.766 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.826 0.346 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.45 HG12 ' HE2' ' A' ' 9' ' ' LYS . 46.2 t -144.36 88.68 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.028 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.575 HD13 ' HG3' ' A' ' 18' ' ' GLN . 79.5 mt -59.41 129.15 21.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 7' ' ' VAL . 75.2 mmtt -112.02 -23.11 10.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.188 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -165.48 85.6 0.37 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.882 0.372 . . . . 0.0 110.863 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.431 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -106.97 95.69 5.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.878 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.51 -11.16 59.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.368 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.484 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 43.4 tpp -78.34 158.73 28.72 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.708 0.29 . . . . 0.0 110.735 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -41.63 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.205 -179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.476 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 44.7 tt0 -178.27 -31.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.58 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -55.42 -32.17 62.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.844 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.484 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.1 mpt? -77.24 -24.84 51.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.563 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.662 ' OE1' HD12 ' A' ' 74' ' ' ILE . 2.0 mp0 -66.67 -45.46 78.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.21 -32.1 29.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.308 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.7 t0 -75.35 -47.55 27.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 110.656 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -66.45 -49.14 67.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.139 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 18' ' ' GLN . 86.2 t -60.23 -41.61 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.79 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -77.12 -31.68 55.93 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.625 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 37.9 t -72.07 -29.81 64.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.1 -26.89 33.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.977 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.3 m -78.9 -45.78 19.85 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.728 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -72.35 -28.35 62.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.743 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -67.53 -56.17 10.59 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.391 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 67.1 mtm -70.11 -20.15 63.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.643 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -81.14 -45.03 17.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -83.78 -26.33 29.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.7 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -137.65 170.03 16.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.492 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 0.4 OUTLIER -154.48 54.79 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 21.4 mt -108.11 -11.11 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.477 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 7.9 mp0 72.69 -54.47 0.69 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.093 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -75.69 -50.23 16.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.406 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 7.6 t70 -57.16 -29.1 63.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.418 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.743 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.6 mm -60.9 -49.79 83.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.476 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.78 -23.66 63.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.474 ' HA ' ' HG3' ' A' ' 43' ' ' LYS . . . -75.99 -45.09 36.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.195 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.4 t80 -67.68 -25.82 65.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.902 0.382 . . . . 0.0 110.391 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.6 mt -80.92 -49.46 18.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.908 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.531 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -68.33 -31.48 70.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.072 179.068 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 29.7 mmmt -72.51 -42.32 64.94 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.316 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -70.35 -27.88 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.437 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.501 ' CD2' HD21 ' A' ' 85' ' ' LEU . 32.2 m-85 -89.01 -38.87 14.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.539 0.209 . . . . 0.0 111.502 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.62 -25.43 49.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.0 111.175 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -87.17 -11.97 48.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.193 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -110.22 -53.68 2.65 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.665 0.269 . . . . 0.0 111.21 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 52.5 m-85 -94.97 16.54 15.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.637 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.412 ' OD1' ' HD2' ' A' ' 52' ' ' PRO . 45.6 t30 62.61 138.68 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.55 0.214 . . . . 0.0 110.851 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OD1' ' A' ' 51' ' ' ASN . 53.2 Cg_exo -55.52 172.49 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.248 1.965 . . . . 0.0 112.125 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.0 m -120.97 125.61 47.82 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.134 0.574 . . . . 0.0 110.789 0.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.452 ' CZ2' ' HG3' ' A' ' 87' ' ' LYS . 8.9 m95 -114.08 174.36 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.516 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.408 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 92.2 m-70 -157.52 92.58 1.23 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.078 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.888 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -79.24 137.71 37.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.534 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.844 ' O ' HG23 ' A' ' 83' ' ' ILE . 13.8 mm -112.73 145.88 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 120.748 0.308 . . . . 0.0 111.508 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.1 p -123.61 75.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.684 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.711 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -178.06 -88.95 0.07 OUTLIER Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.735 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -135.29 -84.16 0.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.641 0.258 . . . . 0.0 111.318 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -151.11 12.79 0.67 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.651 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.6 p90 -60.01 -14.86 18.26 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.432 ' HA3' ' CD1' ' A' ' 57' ' ' ILE . . . -117.14 43.47 1.63 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.013 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.7 p -97.12 63.72 1.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.887 0.375 . . . . 0.0 110.635 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -119.99 45.15 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.54 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.831 HG13 ' HB3' ' A' ' 88' ' ' SER . 97.4 t -130.82 -38.22 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.898 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -49.61 -27.31 4.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.32 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 79.1 t60 -81.92 5.97 17.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.869 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 17.5 tp10 -114.61 -33.91 5.38 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.784 0.325 . . . . 0.0 111.456 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.771 HG22 ' HD3' ' A' ' 71' ' ' LYS . 18.9 m -158.96 -95.97 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.887 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.771 ' HD3' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 156.36 2.23 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 178.549 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.426 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 20.3 m80 -79.2 60.96 3.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.162 0.506 . . . . 0.0 109.93 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 40.3 p90 -111.83 -168.14 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.926 -178.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.662 HD12 ' OE1' ' A' ' 18' ' ' GLN . 7.1 tt -168.57 148.99 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.265 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -128.19 153.15 47.22 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.006 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.672 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 19.0 p90 -170.2 123.96 0.72 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.358 0.599 . . . . 0.0 111.354 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -84.41 118.81 24.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.154 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 6' ' ' ALA . 85.6 mt -116.32 117.63 30.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.716 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.48 -105.75 0.79 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.338 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.64 ' NE2' HG23 ' A' ' 81' ' ' VAL . 1.9 pp0? -126.36 30.19 5.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 111.269 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.711 HG13 ' HA2' ' A' ' 59' ' ' GLY . 85.2 t -142.53 133.81 24.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.37 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.53 118.51 31.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.844 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.6 mp -103.11 137.04 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.009 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.677 HD12 ' CZ ' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -137.31 116.22 12.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.168 0.509 . . . . 0.0 111.899 -179.378 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.888 HD13 ' HB2' ' A' ' 56' ' ' CYS . 63.9 tp -107.18 135.27 48.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.364 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.677 ' CZ ' HD12 ' A' ' 84' ' ' LEU . 1.5 m-85 -130.75 176.12 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 0.0 112.24 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.452 ' HG3' ' CZ2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -141.82 85.62 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.474 179.433 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.831 ' HB3' HG13 ' A' ' 66' ' ' VAL . 99.1 p -71.07 108.0 4.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.818 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' ' HG3' ' A' ' 69' ' ' GLU . . . . . . . . 0 C--O 1.249 1.08 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.558 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.883 0.373 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.526 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 24.0 t -133.14 152.13 35.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.61 HD11 ' CG2' ' A' ' 22' ' ' VAL . 37.5 mt -115.74 114.95 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.509 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -75.02 -38.24 61.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.1 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.614 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 0.9 OUTLIER -164.0 119.0 1.54 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.851 0.358 . . . . 0.0 110.73 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -143.89 140.03 29.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.373 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -131.9 7.68 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.619 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 52.2 tpp -72.0 62.96 0.47 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.981 0.42 . . . . 0.0 111.409 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 42.2 t 68.34 -63.22 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.414 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.563 ' HB2' ' O ' ' A' ' 14' ' ' SER . 41.2 tt0 150.56 -49.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.702 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -52.89 -24.87 10.08 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.873 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.8 mpt? -81.85 -25.22 35.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.28 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.679 ' O ' HG23 ' A' ' 22' ' ' VAL . 34.8 mt-30 -65.75 -42.27 91.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 65.8 tt0 -74.94 -39.79 61.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.185 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.58 -53.81 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.908 0.385 . . . . 0.0 110.764 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.55 -51.48 65.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.309 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 18' ' ' GLN . 70.7 t -56.46 -53.76 36.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -68.46 -23.26 64.57 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.854 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.5 t -72.6 -34.09 67.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.72 -27.06 44.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.827 178.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.524 HG22 ' OE2' ' A' ' 30' ' ' GLU . 89.9 m -77.06 -49.28 15.69 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.954 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -69.67 -25.6 63.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.285 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.572 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -72.63 -42.04 64.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.535 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.6 ttm -71.5 -31.26 66.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.738 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.524 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.2 mt-10 -79.35 -46.78 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.264 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -77.04 -21.47 54.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.405 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 50.8 m-85 -144.37 149.43 36.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.842 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -136.85 43.22 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.029 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.6 mt -99.43 -16.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.418 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.4 mt-10 77.55 -54.81 0.53 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.005 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -75.33 -50.84 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.256 179.577 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.84 -28.12 54.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.08 0.467 . . . . 0.0 110.112 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -61.94 -57.87 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.416 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.15 -24.46 58.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.926 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -77.81 -42.45 33.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.017 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -69.41 -21.91 63.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.3 mt -81.62 -50.36 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.503 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 18.6 ptpt -66.17 -38.64 88.55 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.662 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 1.1 mptm? -65.53 -45.87 81.77 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.58 -44.44 76.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -74.34 -32.47 62.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.389 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.406 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 47.5 m-20 -74.32 -26.69 60.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.698 0.285 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -88.74 -15.62 34.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.512 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -111.96 -26.94 8.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.537 0.208 . . . . 0.0 111.311 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -117.96 1.94 12.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.538 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 61.73 153.46 0.11 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.69 0.281 . . . . 0.0 111.005 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 170.91 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.643 2.229 . . . . 0.0 112.145 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -117.74 119.89 36.29 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.05 0.54 . . . . 0.0 110.294 -0.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.608 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 21.9 m95 -108.63 -172.28 2.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.227 0.537 . . . . 0.0 111.596 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.433 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 15.3 t-160 -171.77 115.44 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.911 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -102.09 145.58 29.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.954 0.407 . . . . 0.0 111.33 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.867 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 27.3 mm -111.71 143.13 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.603 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.673 ' O ' HG13 ' A' ' 58' ' ' VAL . 7.2 p -129.88 58.91 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.566 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -148.02 -109.74 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.859 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 37.6 mmt180 -123.43 -65.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.86 0.362 . . . . 0.0 111.38 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -155.06 20.81 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.55 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 15.0 p90 -76.32 17.04 0.39 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.562 -177.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.422 ' HA3' HG13 ' A' ' 57' ' ' ILE . . . -87.63 28.69 5.73 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.016 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -71.87 57.71 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.258 0.552 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.568 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 65.9 t80 -146.28 24.53 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.347 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.769 HG11 ' HB3' ' A' ' 73' ' ' PHE . 43.6 t -85.96 -54.99 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.774 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 89.5 m -50.91 -32.8 21.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.055 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -54.57 -23.41 16.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.217 0.532 . . . . 0.0 109.728 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.532 ' HB3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -93.71 -76.34 0.48 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.219 179.06 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.837 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -163.45 -107.95 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.818 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.527 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -153.2 32.21 0.47 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.001 0.429 . . . . 0.0 110.899 179.298 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.443 ' C ' ' HE2' ' A' ' 13' ' ' MET . 37.9 m170 -109.24 72.16 0.8 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.451 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.769 ' HB3' HG11 ' A' ' 66' ' ' VAL . 30.5 p90 -106.04 -172.14 2.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.293 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.677 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.1 tt 166.37 107.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.007 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.614 ' CE2' ' HB3' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -119.24 163.68 16.75 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.162 0.506 . . . . 0.0 111.619 178.855 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 7' ' ' VAL . 5.9 p90 -155.09 162.49 41.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.742 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -119.3 133.46 55.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.053 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.909 ' O ' HD12 ' A' ' 78' ' ' LEU . 2.9 pp -140.47 141.0 35.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.979 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.57 -97.25 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.636 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 29.62 1.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.914 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -140.72 133.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.862 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.608 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -100.0 128.62 46.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.01 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 57' ' ' ILE . 65.9 mt -115.51 138.26 46.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.629 ' C ' HD23 ' A' ' 84' ' ' LEU . 5.4 tt -130.18 117.04 19.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.612 -179.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.539 ' HB3' HG23 ' A' ' 74' ' ' ILE . 66.1 tp -109.7 144.17 38.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.553 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.665 ' CG ' HG22 ' A' ' 66' ' ' VAL . 3.8 p90 -165.06 179.79 6.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.608 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -168.85 -177.98 3.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.132 0.491 . . . . 0.0 111.752 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.837 ' HA ' HG22 ' A' ' 70' ' ' THR . 78.5 p -111.57 76.66 0.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.249 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.478 ' N ' ' HD3' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.511 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.888 0.375 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -141.06 104.72 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.695 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -81.81 91.63 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.916 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -57.16 -19.18 18.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.722 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 49.5 t30 179.17 130.96 0.08 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.359 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -120.92 130.66 53.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.594 -179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -132.58 3.39 3.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.451 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.653 ' HE2' ' HG2' ' A' ' 17' ' ' MET . 68.3 mmm -97.45 49.07 1.04 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.028 0.442 . . . . 0.0 111.669 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.488 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 51.1 m 70.48 -63.05 0.42 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.715 178.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.668 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 10.2 pt-20 159.23 -42.25 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.651 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -52.5 -33.2 43.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.995 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.653 ' HG2' ' HE2' ' A' ' 13' ' ' MET . 1.1 mpt? -72.64 -28.29 62.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.199 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.769 ' HA ' HD11 ' A' ' 74' ' ' ILE . 55.8 mm-40 -63.26 -50.14 71.31 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.54 -34.02 64.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.081 179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.444 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 39.1 t70 -74.89 -64.18 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 110.463 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -49.3 -46.26 46.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.32 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 18' ' ' GLN . 53.8 t -59.29 -54.61 31.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.984 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.76 -29.07 69.89 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.636 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.8 m -71.32 -34.0 70.17 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -28.45 51.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.62 178.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.604 HG22 ' OE2' ' A' ' 30' ' ' GLU . 86.7 m -74.58 -51.39 14.71 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.609 179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.448 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -68.1 -23.96 64.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.367 178.908 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.557 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.5 -46.57 63.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 93.6 mmm -70.45 -29.83 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.968 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.604 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.6 mt-10 -78.39 -47.71 17.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.356 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -75.8 -21.23 57.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.75 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -140.76 140.1 34.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.858 0.361 . . . . 0.0 111.03 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -111.02 29.28 7.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.5 mt -116.46 172.27 4.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.609 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.3 mt-10 -111.03 15.12 21.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.712 0.291 . . . . 0.0 111.296 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -119.48 -52.96 2.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.836 0.35 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.81 -23.51 52.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.012 0.434 . . . . 0.0 109.912 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.557 HG23 ' HB1' ' A' ' 28' ' ' ALA . 37.3 mm -65.57 -57.34 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.681 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.67 62.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -83.86 -41.55 17.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.966 0.412 . . . . 0.0 110.959 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.453 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -73.35 -22.55 60.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -86.39 -43.05 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.381 0.61 . . . . 0.0 109.459 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.532 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -71.66 -37.09 70.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.728 179.111 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.5 mttt -75.7 -44.03 44.21 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.3 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . 37.6 tt0 -61.69 -36.48 81.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.9 m-85 -74.92 -40.62 60.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.64 0.257 . . . . 0.0 111.517 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.99 -14.46 60.23 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 45' ' ' GLU . 4.0 ptpp? -82.91 3.94 27.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.929 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -152.25 -44.79 0.1 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.444 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -78.69 -4.1 47.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.372 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 62.99 141.62 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.707 0.289 . . . . 0.0 110.709 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.9 170.67 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.366 2.044 . . . . 0.0 112.163 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 53' ' ' THR . 7.6 t -120.97 111.51 17.59 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.089 0.556 . . . . 0.0 110.576 -0.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 10.3 m95 -101.46 168.49 9.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.06 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -151.81 99.48 2.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.758 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.885 ' HB3' HD13 ' A' ' 85' ' ' LEU . 29.4 p -90.78 130.0 36.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.84 ' O ' HG23 ' A' ' 83' ' ' ILE . 11.9 mm -109.3 149.6 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 49.0 t -134.79 90.07 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.984 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.466 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 175.56 -74.12 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.332 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 56.0 mtp85 -153.11 -78.64 0.11 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.887 0.375 . . . . 0.0 111.279 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.7 p-10 -162.01 24.22 0.11 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.758 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.504 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.8 p90 -67.83 8.58 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -64.95 -67.01 2.19 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.282 -0.961 . . . . 0.0 111.945 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 24.9 m 78.55 41.04 0.11 Allowed 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.416 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 5.3 p90 -179.31 65.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.807 0.337 . . . . 0.0 111.026 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.606 HG21 ' OH ' ' A' ' 75' ' ' TYR . 44.6 t -97.58 -63.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.202 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -90.71 -27.94 18.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.905 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -52.68 -22.2 4.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.311 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' HG22 ' A' ' 70' ' ' THR . 22.5 pt-20 -90.44 -59.56 2.15 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.225 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.674 HG22 ' HA ' ' A' ' 88' ' ' SER . 4.6 t -147.4 -112.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 179.042 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.644 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -166.58 33.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.078 0.466 . . . . 0.0 110.261 179.466 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -120.48 76.36 1.18 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.129 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.518 ' C ' ' HG2' ' A' ' 13' ' ' MET . 30.9 p90 -126.99 151.07 49.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.673 -178.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -133.6 128.43 54.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 178.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.606 ' OH ' HG21 ' A' ' 66' ' ' VAL . 32.5 m-85 -112.74 138.91 48.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.227 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.532 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.7 p90 -162.88 129.64 3.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.235 0.541 . . . . 0.0 110.955 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.572 ' O ' HD23 ' A' ' 78' ' ' LEU . 33.1 t80 -92.36 150.15 21.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 77' ' ' TYR . 90.5 mt -149.21 130.5 14.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.937 0.399 . . . . 0.0 111.104 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.08 -98.47 0.03 OUTLIER Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.916 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.14 31.87 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 0.0 110.85 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.466 HG13 ' HA2' ' A' ' 59' ' ' GLY . 60.8 t -148.61 137.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.972 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -97.43 133.96 41.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.022 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.84 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.1 mt -117.78 138.14 49.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.478 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.618 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -133.93 103.41 5.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 0.0 111.368 -179.807 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.885 HD13 ' HB3' ' A' ' 56' ' ' CYS . 44.8 tp -96.39 108.46 20.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.594 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.49 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.6 p90 -132.81 142.75 49.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.182 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.528 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -123.24 150.99 42.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.627 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.674 ' HA ' HG22 ' A' ' 70' ' ' THR . 82.7 p -93.64 165.36 12.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.525 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HB1' HG13 ' A' ' 22' ' ' VAL . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.784 0.326 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.4 t -149.7 153.69 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.006 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.714 HD13 ' OE1' ' A' ' 18' ' ' GLN . 59.6 mt -130.42 115.79 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.043 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.03 -30.65 34.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.711 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -159.03 133.37 7.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -116.98 128.57 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.134 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -122.32 -16.01 7.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.523 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 17' ' ' MET . 50.3 tpp -88.53 50.56 1.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.106 0.479 . . . . 0.0 111.822 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.63 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 49.7 m 67.79 -65.25 0.25 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.821 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.696 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 tm-20 166.74 -36.18 0.0 OUTLIER 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.567 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 17' ' ' MET . 2.7 p30 -51.35 -40.78 59.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.805 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.54 ' HB2' ' HG2' ' A' ' 13' ' ' MET . 44.8 ttm -72.24 -18.59 61.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.503 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.714 ' OE1' HD13 ' A' ' 8' ' ' ILE . 71.8 mm-40 -66.51 -48.4 69.91 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -69.8 -38.61 76.68 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.863 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -72.15 -63.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.211 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.15 -44.92 32.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.316 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.642 HG13 ' HB1' ' A' ' 6' ' ' ALA . 55.4 t -60.6 -53.31 50.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.035 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.71 -29.85 71.03 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.694 0.283 . . . . 0.0 110.733 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.1 m -71.78 -31.46 66.63 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -83.44 -24.31 31.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.056 178.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.1 m -80.68 -42.57 21.8 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -75.36 -29.0 59.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.064 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.748 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.85 -47.24 60.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.523 179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.493 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.4 mmt -74.3 -23.61 59.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.763 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -77.37 -51.12 11.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.4 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -81.34 -24.78 36.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.083 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -135.35 168.85 18.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -159.14 44.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.066 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG21 ' OD2' ' A' ' 37' ' ' ASP . 31.5 mt -96.83 -16.68 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.5 mt-10 79.38 -53.07 0.42 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.095 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -79.6 -42.36 25.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.615 0.245 . . . . 0.0 110.863 -179.433 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.609 ' OD2' HG21 ' A' ' 34' ' ' ILE . 52.6 m-20 -68.86 -17.99 64.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.022 0.439 . . . . 0.0 110.222 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.748 HG23 ' HB1' ' A' ' 28' ' ' ALA . 43.5 mm -72.38 -54.06 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.4 -26.93 63.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.978 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -78.16 -38.11 44.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.61 -24.69 64.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.968 0.413 . . . . 0.0 110.341 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.3 mt -77.84 -53.28 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.755 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 64.7 pttt -66.02 -35.88 81.75 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.657 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 14.0 tppt? -61.66 -47.23 86.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -58.75 -52.47 65.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.265 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.452 ' CE2' ' HG3' ' A' ' 17' ' ' MET . 13.2 m-85 -67.77 -29.44 68.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -70.7 -26.62 63.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.021 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' NZ ' ' HB3' ' A' ' 48' ' ' LYS . 7.2 ttpm? -89.85 -27.47 19.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -95.55 -50.45 4.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.144 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -91.67 9.3 32.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.371 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 60.69 154.25 0.1 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-O 120.782 0.325 . . . . 0.0 110.901 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 172.12 1.82 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.571 2.181 . . . . 0.0 112.055 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.573 ' O ' HG23 ' A' ' 53' ' ' THR . 9.0 t -121.96 97.11 5.33 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.957 0.503 . . . . 0.0 110.651 -0.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.456 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 13.6 m95 -90.46 172.16 8.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 77.5 t60 -155.06 105.26 2.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.588 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.0 t -75.48 145.96 41.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.164 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 62' ' ' PHE . 35.9 mm -111.89 145.46 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.885 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.752 ' O ' HG13 ' A' ' 58' ' ' VAL . 9.6 p -133.53 63.82 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 121.246 0.546 . . . . 0.0 111.503 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -157.1 -92.47 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.448 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -125.75 -84.85 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.715 0.293 . . . . 0.0 111.088 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.9 p-10 -158.72 15.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.47 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 57' ' ' ILE . 9.7 p90 -53.97 -46.13 71.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.826 0.346 . . . . 0.0 111.353 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.47 ' HA3' HG23 ' A' ' 66' ' ' VAL . . . 79.47 -21.28 4.51 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.626 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 26.3 t 70.69 -53.43 0.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.915 0.358 . . . . 0.0 111.123 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -164.88 69.66 0.16 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.124 0.487 . . . . 0.0 111.256 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.612 HG22 ' CD2' ' A' ' 86' ' ' PHE . 42.1 t -91.26 -74.95 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.326 -179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.8 m -43.6 -29.4 0.48 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.522 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 29.1 m80 -44.97 -26.77 0.46 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 12.2 pt-20 167.43 50.14 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.97 0.414 . . . . 0.0 111.158 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.547 HG21 HG13 ' A' ' 66' ' ' VAL . 35.7 m -102.93 -86.89 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.444 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.1 OUTLIER 72.44 -18.24 0.34 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.333 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.461 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 2.9 m-70 -122.23 77.33 1.39 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.738 0.304 . . . . 0.0 110.286 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.438 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 6.4 p90 -125.43 -172.27 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.047 0.451 . . . . 0.0 111.434 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.525 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.5 tt -157.8 129.7 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.259 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.682 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.2 m-30 -106.63 130.78 54.32 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.518 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.475 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.8 p90 -152.73 123.26 7.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.238 0.542 . . . . 0.0 111.411 179.033 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -93.2 140.7 29.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.721 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.677 HD23 ' N ' ' A' ' 78' ' ' LEU . 1.3 pt? -154.17 138.04 16.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.97 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.89 -100.82 0.59 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.541 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -140.99 23.68 2.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.737 0.303 . . . . 0.0 111.003 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 61.1 t -150.78 150.02 13.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.125 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.76 130.47 44.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.018 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.611 HG23 ' O ' ' A' ' 57' ' ' ILE . 66.0 mt -110.34 137.7 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 85' ' ' LEU . 3.6 tt -129.57 119.6 23.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 111.539 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.645 ' N ' HD23 ' A' ' 84' ' ' LEU . 57.3 tp -109.61 119.75 40.36 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.612 ' CD2' HG22 ' A' ' 66' ' ' VAL . 6.3 p90 -136.87 173.08 12.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.438 0.637 . . . . 0.0 112.45 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.456 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -134.9 84.53 2.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.464 179.024 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 80.0 p -72.22 68.22 0.72 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.463 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.432 -1.204 . . . . 0.0 112.447 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.3 t -134.05 147.01 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.04 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 76' ' ' PHE . 25.7 mt -121.64 112.85 36.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' A' ' 9' ' ' LYS . 3.3 mmmp? -66.53 -43.31 85.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.719 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 49.8 t30 -161.39 138.91 8.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.12 94.99 2.94 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.385 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.488 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 33.5 t70 -80.58 -1.74 43.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.653 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.459 ' HE1' ' HB3' ' A' ' 72' ' ' HIS . 47.8 tpp -86.18 165.13 16.78 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' MET . 80.4 p -36.4 -81.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.757 0.313 . . . . 0.0 111.818 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 176.76 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.207 0.527 . . . . 0.0 110.184 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -56.8 -24.6 51.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.582 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.402 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 2.0 mpt? -80.06 -28.29 39.24 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.448 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.77 ' O ' HG23 ' A' ' 22' ' ' VAL . 34.0 mt-30 -65.18 -47.08 78.25 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.692 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -77.25 -35.43 55.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.212 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.446 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.4 t70 -71.07 -53.33 15.05 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.265 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.66 -49.86 67.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.0 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 18' ' ' GLN . 80.1 t -54.65 -49.87 64.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.099 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -71.36 -27.31 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.022 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 95.3 m -71.79 -33.49 68.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.439 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.75 39.13 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.968 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.5 m -79.17 -45.75 19.29 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.904 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -73.69 -25.28 60.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.279 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.633 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -71.96 -53.26 13.58 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 66.2 mtt -73.48 -20.7 60.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.101 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -78.04 -50.67 11.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.879 0.371 . . . . 0.0 110.741 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -81.99 -23.61 35.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.141 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -131.89 165.91 22.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.85 0.357 . . . . 0.0 111.05 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -156.02 35.88 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.998 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 29.7 mt -98.3 -10.58 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.519 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 78.12 -55.1 0.5 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.105 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.42 -53.04 26.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.676 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.81 -25.39 55.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.633 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -65.63 -55.86 17.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.499 179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.32 -23.39 64.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.985 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.424 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -80.24 -39.0 29.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.851 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.27 -27.16 66.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.406 . . . . 0.0 110.088 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.409 HG21 ' SG ' ' A' ' 56' ' ' CYS . 76.2 mt -80.85 -48.67 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.652 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -67.23 -31.77 72.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.086 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.1 mttt -80.48 -29.43 37.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.1 -39.5 78.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.823 0.344 . . . . 0.0 111.167 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.639 ' CD2' HD21 ' A' ' 85' ' ' LEU . 3.8 m-85 -82.05 -36.09 28.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.257 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.07 -17.63 56.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 21.8 ptmt -85.59 3.79 39.12 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.446 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 48' ' ' LYS . 10.4 mtmp? -142.7 -48.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.926 0.393 . . . . 0.0 110.829 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -87.51 6.26 35.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 60.59 156.07 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-O 120.727 0.299 . . . . 0.0 110.721 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 39.8 Cg_exo -56.65 167.03 3.13 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.394 2.063 . . . . 0.0 112.053 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.0 t -139.08 126.98 22.21 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.241 0.616 . . . . 0.0 110.565 0.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.735 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 1.3 m95 -112.19 -171.28 1.82 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.292 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 50.1 m80 -157.39 58.2 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.281 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.855 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.0 t -48.91 133.52 17.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.673 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.795 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 30.9 mm -106.05 142.21 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.687 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.739 ' O ' HG13 ' A' ' 58' ' ' VAL . 10.9 p -129.73 72.16 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.477 -179.546 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.66 -92.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.145 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 11.5 mtp-105 -157.59 67.24 0.5 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.653 0.263 . . . . 0.0 110.894 -179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.504 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER 52.15 12.9 0.24 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.394 179.756 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.795 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.8 p90 -51.67 -25.87 8.05 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.311 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.412 ' N ' ' CD1' ' A' ' 62' ' ' PHE . . . -121.29 48.06 0.98 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.701 179.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.44 ' HA ' HD23 ' A' ' 84' ' ' LEU . 79.9 p -77.6 56.63 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.539 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' A' ' 68' ' ' HIS . 3.1 p90 -98.73 37.7 1.46 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 0.0 110.448 179.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.952 HG22 ' CD2' ' A' ' 86' ' ' PHE . 66.2 t -46.15 -54.26 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.597 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -50.8 -32.54 20.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.052 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.404 ' HB3' ' O ' ' A' ' 65' ' ' TYR . 0.9 OUTLIER -53.65 -24.01 12.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.561 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 88' ' ' SER . 9.5 mp0 -92.78 -77.51 0.44 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.598 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.874 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -176.55 -95.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.845 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.74 ' H ' HG23 ' A' ' 70' ' ' THR . 2.4 mptp? -152.79 22.62 0.59 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.459 ' HB3' ' HE1' ' A' ' 13' ' ' MET . 43.3 m170 -113.12 73.7 0.83 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.987 0.422 . . . . 0.0 110.856 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.528 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 5.8 p90 -113.68 -179.87 3.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.801 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ILE . 7.7 tt 176.39 108.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.998 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 1.1 p90 -113.64 162.57 16.08 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.23 0.538 . . . . 0.0 111.513 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 78' ' ' LEU . 1.3 p90 -153.38 159.05 42.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.111 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.451 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 1.4 t80 -109.78 121.5 45.36 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.96 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.573 HD11 ' HE2' ' A' ' 76' ' ' PHE . 78.7 mt -119.86 112.26 18.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.053 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.41 -90.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.75 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.42 31.89 2.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.909 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.6 t -146.55 126.14 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.09 134.9 37.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.27 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.778 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.7 mt -115.43 135.8 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.651 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 64' ' ' SER . 52.1 tp -124.36 107.01 10.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.855 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.8 tp -108.64 130.61 55.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.561 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.952 ' CD2' HG22 ' A' ' 66' ' ' VAL . 2.9 p90 -157.54 151.85 24.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.336 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.735 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -127.92 152.87 47.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.244 0.545 . . . . 0.0 111.774 -179.604 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.874 ' HA ' HG22 ' A' ' 70' ' ' THR . 33.1 t -100.57 77.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.288 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLY . . . . . 0.538 ' O ' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.406 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 52.0 p-10 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.482 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 2.5 m-70 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.799 0.333 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.8 p -59.42 117.2 4.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.963 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -177.66 100.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.084 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.453 ' HD2' ' N ' ' A' ' 4' ' ' ARG . 10.2 mpt_? -103.88 -177.93 3.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.59 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.39 50.38 2.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.78 115.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -155.29 96.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.1 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' HG2' ' A' ' 18' ' ' GLN . 69.0 mt -79.21 112.43 17.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.948 0.404 . . . . 0.0 110.994 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -80.97 -32.36 34.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.933 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -168.45 114.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.619 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -112.49 117.96 33.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.452 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.87 -13.68 18.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.844 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 41.9 tpp -75.32 170.91 15.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.377 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.0 t -73.38 38.01 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 68.65 -43.91 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -45.39 -40.22 7.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.619 0.247 . . . . 0.0 111.64 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.527 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -71.91 -26.42 62.3 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.16 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.673 ' HG2' HD13 ' A' ' 8' ' ' ILE . 34.2 mt-30 -64.79 -42.62 94.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -77.09 -40.13 47.14 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.183 178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -70.98 -57.67 4.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.379 . . . . 0.0 110.907 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.688 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -55.21 -49.83 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.534 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 18' ' ' GLN . 61.3 t -57.66 -44.82 86.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.352 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -73.96 -30.63 62.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 85.7 m -71.97 -32.99 67.8 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -80.93 -24.91 37.85 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.252 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.406 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 93.4 m -81.25 -43.83 18.63 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.995 0.426 . . . . 0.0 109.925 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.416 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 17.7 tt0 -74.87 -26.27 59.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.384 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -78.56 -39.39 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.094 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.406 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.4 ptt? -77.21 -26.86 53.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.49 ' OE2' ' HB2' ' A' ' 31' ' ' LYS . 0.8 OUTLIER -87.01 -37.66 17.3 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HB2' ' OE2' ' A' ' 30' ' ' GLU . 24.3 ttmm -79.21 -28.31 42.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.203 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -146.73 176.28 9.98 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.803 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -158.04 27.49 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.173 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 35.6 mm -75.35 -13.03 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.549 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 42.9 mt-10 76.56 -54.46 0.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.036 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -74.81 -50.15 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.94 0.4 . . . . 0.0 110.572 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -56.26 -29.6 61.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.15 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.401 HG23 ' CB ' ' A' ' 28' ' ' ALA . 44.3 mm -62.3 -56.06 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.634 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.75 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.25 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.465 ' O ' ' CB ' ' A' ' 44' ' ' LYS . . . -78.66 -41.49 31.15 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.78 -26.36 65.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.1 mt -80.32 -48.27 20.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.942 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 2.7 pptp? -69.69 -32.67 71.42 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.764 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 51.9 tttp -68.24 -44.98 74.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.939 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.73 -43.4 98.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.1 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.16 -16.71 52.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.615 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -87.0 -43.02 12.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.795 0.331 . . . . 0.0 111.115 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -90.26 21.77 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.649 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -138.0 -42.87 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.659 0.266 . . . . 0.0 111.226 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -111.29 10.6 21.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.664 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 62.5 142.72 0.06 OUTLIER Pre-proline 0 CA--C 1.529 0.165 0 CA-C-O 120.638 0.256 . . . . 0.0 110.898 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -50.0 173.91 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.339 2.026 . . . . 0.0 112.358 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -125.15 112.28 16.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.015 0.526 . . . . 0.0 110.611 -0.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.549 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 7.1 m95 -102.32 -167.29 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.802 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 22.6 t-80 -176.14 90.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.767 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -89.19 144.32 26.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.491 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.608 ' O ' HG23 ' A' ' 83' ' ' ILE . 9.2 mm -115.15 150.94 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.66 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.515 ' HA ' HG12 ' A' ' 83' ' ' ILE . 47.7 t -137.42 91.66 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.267 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.77 -83.55 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.218 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.53 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 64.0 mtm-85 -140.97 -75.86 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.38 . . . . 0.0 111.137 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 35.6 p-10 -161.07 23.1 0.13 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.895 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.7 p90 -71.91 2.47 5.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -177.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.81 -58.6 13.72 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m 44.69 54.01 6.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.477 ' CG ' ' O ' ' A' ' 65' ' ' TYR . 37.8 t80 -165.77 31.6 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.745 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.662 HG13 ' HB3' ' A' ' 73' ' ' PHE . 59.7 t -84.6 -72.77 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.396 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.6 m -69.64 -26.07 64.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.996 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -46.62 -25.29 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.847 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.526 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 17.1 pt-20 -103.88 -63.6 1.18 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.709 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.817 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.6 t -150.94 -116.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HD2' ' C ' ' A' ' 70' ' ' THR . 7.5 mptt -154.29 30.61 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.685 0.278 . . . . 0.0 110.954 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -105.94 68.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.871 0.367 . . . . 0.0 110.894 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.662 ' HB3' HG13 ' A' ' 66' ' ' VAL . 5.6 p90 -117.74 175.5 5.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.176 0.512 . . . . 0.0 111.434 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 74' ' ' ILE . 9.4 tt -160.4 110.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.359 178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.46 ' CE2' ' CE1' ' A' ' 73' ' ' PHE . 66.4 m-85 -91.4 140.04 30.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.921 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.688 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 24.8 p90 -161.14 121.0 2.65 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 110.079 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.463 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 31.6 t80 -92.6 139.22 30.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.949 -177.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -111.5 162.98 14.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.89 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -51.79 100.14 0.05 OUTLIER Glycine 0 CA--C 1.521 0.418 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.423 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.46 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.1 mp0 71.85 25.09 3.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.149 0.499 . . . . 0.0 110.685 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.484 HG12 ' N ' ' A' ' 82' ' ' ALA . 95.9 t -155.54 158.82 3.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.924 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -132.42 143.12 49.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.704 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.641 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 54.0 mt -140.16 137.78 37.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.724 0.297 . . . . 0.0 110.68 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.667 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -138.12 115.67 11.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 56' ' ' CYS . 56.1 tp -102.18 130.73 48.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.629 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.475 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.3 p90 -151.67 157.71 42.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.549 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -146.62 162.67 37.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.942 -179.798 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.817 ' HA ' HG22 ' A' ' 70' ' ' THR . 93.4 p -94.07 167.8 11.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.054 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.528 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.786 0.327 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.3 t -159.52 125.08 4.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.848 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 67.0 t0 -93.36 48.16 1.3 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.954 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.611 ' HE ' HG21 ' A' ' 7' ' ' VAL . 68.1 mtp180 78.36 108.79 0.07 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.29 0.567 . . . . 0.0 110.386 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 6' ' ' ALA . 86.5 tttt -121.86 27.68 7.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.169 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 5' ' ' LYS . . . 169.22 103.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.254 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.611 HG21 ' HE ' ' A' ' 4' ' ' ARG . 57.8 t -148.79 107.98 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.088 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.759 HD13 ' OE1' ' A' ' 18' ' ' GLN . 68.4 mt -86.05 115.85 28.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.899 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -84.84 -31.08 24.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.621 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -171.9 112.08 0.3 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.723 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -132.06 105.94 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.036 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.426 ' OD1' ' CD1' ' A' ' 73' ' ' PHE . 12.6 p-10 -77.63 -4.41 45.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.245 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.503 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.3 tpp -75.02 165.77 24.73 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' CG ' ' A' ' 15' ' ' GLU . 79.8 p -50.54 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.669 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 47.4 mt-10 -162.99 -36.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.55 0.691 . . . . 0.0 110.194 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.53 -27.64 57.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.503 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.9 mpt? -77.67 -25.35 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.441 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.759 ' OE1' HD13 ' A' ' 8' ' ' ILE . 41.2 mm-40 -65.51 -50.12 66.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -77.48 -32.47 54.36 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.688 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.1 t0 -73.64 -50.4 21.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.858 0.361 . . . . 0.0 110.602 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -59.82 -47.77 84.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.315 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -58.76 -51.61 69.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.066 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.21 -28.39 65.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.556 0.217 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 24.7 t -71.48 -32.34 68.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.01 -25.55 37.12 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.115 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.1 m -79.55 -45.11 19.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.119 0.485 . . . . 0.0 109.811 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.51 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 86.3 mt-30 -73.12 -26.34 61.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.324 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.67 -39.96 50.49 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.075 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -73.1 -32.33 64.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.51 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 12.4 pt-20 -80.58 -45.28 17.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.104 0.478 . . . . 0.0 109.758 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.402 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 57.0 tptt -71.52 -20.82 61.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.673 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -142.49 133.14 25.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.903 0.382 . . . . 0.0 111.088 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 -102.72 29.94 5.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.492 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.512 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.8 mt -115.11 168.79 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.512 ' H ' HG22 ' A' ' 34' ' ' ILE . 16.7 pt-20 -113.24 18.87 17.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.524 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -125.97 -44.39 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.732 0.301 . . . . 0.0 110.223 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -68.2 -17.09 64.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.444 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 40.1 mm -69.63 -51.76 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.399 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.78 -22.16 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.108 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.66 -38.89 25.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' A' ' 45' ' ' GLU . 6.5 t80 -70.54 -26.31 63.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.19 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.418 HG21 ' CB ' ' A' ' 56' ' ' CYS . 78.6 mt -84.01 -43.85 17.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 62.8 tttp -67.26 -35.6 79.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.64 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 26.6 tptp -68.86 -59.89 2.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.387 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' A' ' 41' ' ' TYR . 5.4 mm-40 -49.57 -51.72 35.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.89 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.66 ' CD2' HD21 ' A' ' 85' ' ' LEU . 14.6 m-85 -67.75 -31.23 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.395 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 6.3 t70 -73.58 -26.27 60.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -90.05 -24.77 21.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.98 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -95.76 -57.91 2.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.202 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -94.69 17.05 14.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 58.98 161.17 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.33 170.2 15.29 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.602 2.201 . . . . 0.0 111.922 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.0 m -124.5 104.73 8.89 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.282 0.633 . . . . 0.0 110.572 -0.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.453 ' HZ3' ' HE3' ' A' ' 13' ' ' MET . 7.3 m95 -99.9 -171.11 1.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.59 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 77.9 t60 -179.98 85.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.955 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.832 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -66.65 153.28 43.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.861 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.899 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.6 mm -118.16 138.73 47.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.282 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.615 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.6 p -119.48 62.39 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.46 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.68 -92.73 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.597 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.826 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 79.0 mtt-85 -144.94 -65.25 0.34 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.0 111.349 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 36.1 p-10 -156.87 19.3 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.843 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.673 ' CE1' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -67.49 5.16 0.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.14 57.82 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.878 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.9 m -69.08 55.47 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.027 0.441 . . . . 0.0 111.662 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 4.7 m-85 -99.22 35.11 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.55 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 66' ' ' VAL . 44.2 t -98.48 -1.34 10.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.791 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.9 m -115.55 -27.7 7.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 0.0 111.043 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.554 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 36.1 m80 -50.12 -26.43 4.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.242 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 22.6 pt-20 156.66 45.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 120.889 0.376 . . . . 0.0 110.975 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 20.0 m -94.04 -84.05 0.32 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.481 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 74.84 -12.41 0.94 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.536 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.443 ' H ' HG22 ' A' ' 70' ' ' THR . 9.0 t-160 -139.02 82.87 1.92 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.527 ' HD1' ' N ' ' A' ' 74' ' ' ILE . 7.7 p90 -110.51 -172.3 2.0 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.085 0.469 . . . . 0.0 111.753 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.723 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.5 tt -160.93 113.16 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.749 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 8.1 m-30 -100.94 153.72 19.28 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.484 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 20.6 p90 -170.27 137.49 1.5 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.721 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.458 ' O ' HD23 ' A' ' 78' ' ' LEU . 1.3 t80 -93.67 134.24 36.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.158 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.897 HD12 HD12 ' A' ' 83' ' ' ILE . 81.4 mt -131.72 125.44 32.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.84 -110.94 1.42 Allowed Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.086 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.433 ' C ' HG23 ' A' ' 81' ' ' VAL . 50.8 mm-40 -128.61 49.65 2.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.346 0.593 . . . . 0.0 110.603 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.433 HG23 ' C ' ' A' ' 80' ' ' GLN . 91.7 t -160.2 138.61 2.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.638 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.826 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -83.91 134.06 34.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.272 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.899 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.3 mt -135.69 133.41 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.724 HD13 ' N ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -148.87 143.89 26.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.743 -0.783 . . . . 0.0 112.474 -179.722 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' ' 56' ' ' CYS . 61.1 tp -116.81 155.99 28.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.271 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.464 ' H ' HD12 ' A' ' 85' ' ' LEU . 10.9 p90 -164.3 158.68 19.04 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 0.0 111.977 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.44 ' HB2' ' CH2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -108.25 76.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.737 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 81.2 p -74.91 73.97 2.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.407 -1.219 . . . . 0.0 112.56 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.51 ' HA ' ' CE ' ' A' ' 1' ' ' MET . 10.4 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.862 0.363 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t 60.04 31.67 20.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 62.29 90.26 0.08 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.946 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -124.88 42.68 3.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.672 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 22.1 pttp -113.9 50.01 0.95 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.847 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 67.27 108.86 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.21 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 52.0 p-10 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.482 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 2.5 m-70 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.1 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.885 0.374 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t -139.58 161.32 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.7 t0 60.41 76.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.693 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 50.3 mtp85 -103.07 -41.09 6.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.825 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 44.02 48.72 7.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.402 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . -177.98 100.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.443 HG12 ' N ' ' A' ' 8' ' ' ILE . 45.1 t -147.9 155.17 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.992 0.425 . . . . 0.0 111.635 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.817 HD11 ' HB3' ' A' ' 18' ' ' GLN . 77.6 mt -130.11 123.19 55.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.668 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -87.14 -31.93 20.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.442 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -178.99 110.92 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.607 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.776 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -156.1 144.95 20.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.191 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.486 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.3 t70 -143.47 18.22 1.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.61 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.499 ' CG ' ' HG3' ' A' ' 17' ' ' MET . 50.3 tpp -69.5 65.65 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.69 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 47.1 t 56.97 12.7 1.27 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 47.6 mt-10 69.35 -49.77 0.61 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -46.31 -36.16 6.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.646 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.624 ' HB2' HD12 ' A' ' 74' ' ' ILE . 21.8 mmt -75.84 -24.41 55.81 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.769 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.817 ' HB3' HD11 ' A' ' 8' ' ' ILE . 64.9 mt-30 -67.02 -41.7 86.16 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -82.53 -34.54 27.86 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.021 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' OD1' ' A' ' 23' ' ' ASP . 7.8 t0 -74.81 -37.76 62.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.154 0.502 . . . . 0.0 110.527 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.465 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -71.01 -45.66 63.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.708 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 18' ' ' GLN . 73.9 t -59.43 -55.11 25.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.266 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 20' ' ' ASP . 57.7 p30 -67.25 -25.23 65.98 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.057 -0.257 . . . . 0.0 110.987 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 54.1 t -72.46 -36.53 68.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -75.12 -26.33 59.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.645 178.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -76.65 -53.97 7.3 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.745 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.419 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -63.4 -24.57 67.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.451 178.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.02 58.42 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.64 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.6 ptp -75.75 -24.6 56.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.131 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -79.35 -51.01 9.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.0 110.075 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -72.16 -27.12 62.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.575 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -135.3 146.79 48.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.753 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -134.44 42.57 2.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.027 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.5 mt -101.43 -13.31 8.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.555 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.9 mt-10 76.85 -54.51 0.57 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.212 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -71.98 -56.03 6.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.485 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.465 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.07 -25.49 31.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.249 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.61 -49.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.38 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.736 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -65.15 -22.58 66.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.161 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.55 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.74 -40.42 22.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.403 ' O ' ' CD1' ' A' ' 41' ' ' TYR . 5.4 t80 -68.36 -28.35 67.05 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.33 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 25' ' ' ALA . 96.5 mt -77.36 -49.92 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.985 179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.6 ptmt -65.34 -36.26 83.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.55 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.7 tptm -55.24 -55.55 30.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.65 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.06 -54.97 38.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.839 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.444 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.8 m-85 -63.54 -20.05 65.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.263 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -74.44 -56.31 4.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.656 0.265 . . . . 0.0 111.255 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HE2' ' CE ' ' A' ' 44' ' ' LYS . 68.1 mttm -87.0 7.81 26.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.757 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -114.37 -29.89 6.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 111.025 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CZ ' ' CE ' ' A' ' 17' ' ' MET . 48.6 m-85 -130.37 6.55 4.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.42 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.53 150.63 0.1 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-O 120.636 0.255 . . . . 0.0 111.049 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -56.92 172.55 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.526 2.151 . . . . 0.0 112.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -121.97 126.4 48.49 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.105 0.562 . . . . 0.0 110.709 -0.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.482 ' CZ2' ' HG2' ' A' ' 87' ' ' LYS . 3.6 m95 -122.29 172.17 8.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.758 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.412 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 37.9 m80 -149.74 81.62 1.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.327 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.662 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.2 p -72.9 138.38 46.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.799 ' O ' HG23 ' A' ' 83' ' ' ILE . 29.2 mm -109.04 147.15 13.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.379 179.274 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.736 HG21 ' HB2' ' A' ' 39' ' ' ALA . 52.9 t -129.44 74.27 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.713 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 178.94 -100.16 0.14 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.383 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -126.68 -77.1 0.58 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 120.881 0.372 . . . . 0.0 110.882 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.8 p-10 -156.53 19.44 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.091 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.656 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 8.1 p90 -58.62 -15.53 12.0 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.62 54.26 0.76 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.46 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.446 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 41.0 t -60.88 -95.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.412 ' OH ' ' HB3' ' A' ' 55' ' ' HIS . 36.9 p90 41.71 37.87 0.83 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.476 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.977 HG22 ' CE1' ' A' ' 86' ' ' PHE . 47.6 t -60.07 -39.04 79.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.1 m -68.94 -29.13 67.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -49.79 -26.09 3.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 110.27 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 8.8 mp0 -82.01 -77.25 0.23 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.416 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.2 t -172.42 -86.63 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.272 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.825 ' H ' HG23 ' A' ' 70' ' ' THR . 1.5 tptm -166.95 29.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.214 0.53 . . . . 0.0 109.841 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.422 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 93.4 m-70 -129.29 81.27 2.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.618 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 5.9 p90 -112.7 179.06 4.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.929 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.776 HG13 ' HB1' ' A' ' 11' ' ' ALA . 8.0 tt -162.29 111.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.457 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.904 ' OH ' HG21 ' A' ' 66' ' ' VAL . 7.0 m-30 -100.61 151.03 22.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.465 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 1.7 p90 -168.18 116.4 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.967 0.413 . . . . 0.0 110.802 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.657 ' O ' HD23 ' A' ' 78' ' ' LEU . 4.3 t80 -84.7 141.14 30.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.89 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 77' ' ' TYR . 80.0 mt -139.05 135.8 34.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.18 -93.15 0.01 OUTLIER Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.761 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.907 ' OE1' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -139.93 20.9 2.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.688 0.28 . . . . 0.0 111.608 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.907 HG23 ' OE1' ' A' ' 80' ' ' GLN . 92.3 t -140.26 129.95 28.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.87 0.367 . . . . 0.0 110.862 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -89.08 128.53 35.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.818 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.799 HG23 ' O ' ' A' ' 57' ' ' ILE . 59.7 mt -104.11 135.87 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.844 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.578 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 10.2 mp -122.42 107.45 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.609 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 56' ' ' CYS . 65.4 tp -110.01 120.35 42.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.872 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.977 ' CE1' HG22 ' A' ' 66' ' ' VAL . 1.5 m-85 -111.1 165.14 12.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.868 0.366 . . . . 0.0 111.055 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HG2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -136.44 117.72 14.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.659 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 70' ' ' THR . 46.1 t -98.41 151.81 20.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.913 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.537 179.923 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 mmt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.805 0.336 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 t -89.65 111.75 22.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -161.93 30.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 4' ' ' ARG . 5.0 mmp_? -107.08 -73.73 0.68 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.85 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 58.24 91.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.799 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 62.25 98.46 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.023 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.508 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 55.4 t -143.83 138.83 25.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.096 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.878 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.1 mp -103.97 136.44 37.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.206 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 61.7 mttp -94.28 29.0 2.32 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.577 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.715 ' H ' HG22 ' A' ' 8' ' ' ILE . 45.1 t30 87.68 106.68 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.328 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.467 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -126.88 179.05 5.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.05 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -168.6 19.22 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.541 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 44.8 ttp -80.35 62.88 4.63 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.206 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 45.6 m 72.55 1.57 4.03 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' SER . 46.7 mt-10 70.5 -51.18 0.66 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.783 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -48.26 -29.25 3.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.945 0.402 . . . . 0.0 110.326 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.485 ' HG2' ' HE3' ' A' ' 13' ' ' MET . 1.0 OUTLIER -72.72 -29.86 63.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.464 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.872 ' HA ' HD11 ' A' ' 74' ' ' ILE . 35.2 mt-30 -65.29 -38.33 89.89 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -73.63 -44.43 57.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.39 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.71 -54.33 9.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.258 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.516 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -55.35 -52.1 64.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.425 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 18' ' ' GLN . 78.1 t -57.6 -50.56 76.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.036 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.3 m-20 -69.79 -24.75 63.54 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.787 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -71.75 -38.05 70.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.62 -23.02 53.38 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.779 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.402 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 89.3 m -78.92 -50.88 10.47 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.526 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 23.9 pt20 -69.74 -23.92 63.46 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.373 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.431 ' C ' HD12 ' A' ' 38' ' ' ILE . . . -76.88 -43.49 35.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.062 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.402 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.1 ptt? -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.739 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.3 pt-20 -84.25 -43.95 14.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.049 0.452 . . . . 0.0 109.932 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.405 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 99.1 mttt -74.2 -21.02 59.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.503 ' HB2' HD11 ' A' ' 38' ' ' ILE . 2.3 m-85 -131.28 -172.24 2.79 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.701 0.286 . . . . 0.0 110.808 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -173.97 35.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.807 0.337 . . . . 0.0 111.122 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.692 HD12 ' OD2' ' A' ' 37' ' ' ASP . 31.2 mt -99.41 -18.07 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 67.45 11.86 8.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.305 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -129.07 -54.44 1.2 Allowed 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' HD12 ' A' ' 34' ' ' ILE . 26.7 m-20 -58.7 -23.03 58.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 32' ' ' TYR . 44.3 mm -61.37 -58.55 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.359 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.654 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -62.55 -21.21 65.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.937 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -81.81 -41.57 20.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.985 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -70.15 -22.82 62.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.809 0.338 . . . . 0.0 110.582 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.9 mt -82.31 -48.45 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 23.5 pttm -70.47 -33.75 71.62 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.842 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 59.1 mtpt -72.49 -38.42 68.16 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -61.71 -40.81 96.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 110.431 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.5 m-85 -81.51 -36.73 28.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.396 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -75.03 -26.62 59.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.664 0.269 . . . . 0.0 111.369 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -90.24 29.52 1.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.813 0.339 . . . . 0.0 111.212 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -155.0 -44.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.678 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -106.94 -4.89 18.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.461 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.449 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 74.0 m-80 63.53 162.33 0.12 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-O 120.647 0.261 . . . . 0.0 111.122 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HB3' HG22 ' A' ' 53' ' ' THR . 79.6 Cg_exo -46.32 173.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.826 2.351 . . . . 0.0 112.38 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.541 HG22 ' HB3' ' A' ' 52' ' ' PRO . 66.7 p -119.24 115.08 23.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.232 0.613 . . . . 0.0 110.629 -0.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.66 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 1.1 m95 -114.62 -174.13 2.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.136 0.493 . . . . 0.0 110.932 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.439 ' CD2' ' O ' ' A' ' 54' ' ' TRP . 26.5 m170 -163.45 61.8 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.202 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -53.52 137.88 35.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.402 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.814 ' O ' HG23 ' A' ' 83' ' ' ILE . 28.8 mm -115.59 149.84 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.343 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.654 HG21 ' HB2' ' A' ' 39' ' ' ALA . 47.7 t -141.34 53.83 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.132 0.491 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -155.06 -67.3 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.72 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.961 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -177.23 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.681 0.276 . . . . 0.0 111.351 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.408 ' N ' ' HG2' ' A' ' 60' ' ' ARG . 39.1 p-10 -172.5 18.54 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.669 ' CE1' HG23 ' A' ' 57' ' ' ILE . 39.4 p90 -59.89 -33.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.431 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.76 -58.21 5.45 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.337 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.422 ' O ' ' CD1' ' A' ' 65' ' ' TYR . 81.2 p 51.41 75.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD1' ' O ' ' A' ' 64' ' ' SER . 23.1 m-85 -143.1 29.72 1.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.214 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.623 HG21 ' OH ' ' A' ' 75' ' ' TYR . 47.7 t -58.73 -62.08 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.701 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.405 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 86.6 m -55.52 -31.7 62.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.83 0.347 . . . . 0.0 110.949 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 88' ' ' SER . 1.0 OUTLIER -77.13 -5.52 49.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.066 178.892 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 89.3 mt-10 -160.47 50.58 0.28 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 66' ' ' VAL . 98.9 m -86.48 -9.05 57.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.579 ' HA ' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -45.28 -24.66 0.3 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.718 0.294 . . . . 0.0 111.744 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -171.91 99.92 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.109 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.541 ' O ' ' HB2' ' A' ' 13' ' ' MET . 2.1 p90 -113.97 166.55 11.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.502 . . . . 0.0 111.761 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.872 HD11 ' HA ' ' A' ' 18' ' ' GLN . 8.2 tt -158.79 123.71 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.001 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.878 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 m-30 -111.18 139.31 46.67 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.516 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.8 p90 -170.47 132.37 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.025 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.606 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 2.5 p90 -126.43 154.31 43.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.737 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 6' ' ' ALA . 81.5 mt -115.58 103.13 10.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.519 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.26 -86.67 0.4 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.485 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -124.63 -11.79 7.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.7 t -95.59 120.15 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.718 0.294 . . . . 0.0 110.778 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.961 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -98.48 129.0 45.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 111.758 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 57' ' ' ILE . 69.3 mt -109.34 131.39 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.014 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 83' ' ' ILE . 6.4 mp -127.88 107.79 10.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.646 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 46' ' ' PHE . 67.0 tp -106.91 133.81 51.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.405 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.516 ' HB3' ' HA ' ' A' ' 73' ' ' PHE . 10.6 p90 -169.72 157.09 6.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.087 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.66 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -144.99 157.67 44.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.281 0.563 . . . . 0.0 111.795 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.514 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 41.9 t -87.61 179.49 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.2 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.332 -1.26 . . . . 0.0 112.451 179.692 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.4 mtp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.81 0.338 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.3 t -146.84 -175.96 5.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.783 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -163.92 71.86 0.24 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -103.18 -37.83 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.633 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -90.92 46.57 1.33 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.811 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . -177.44 93.33 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.488 ' HB ' ' CZ ' ' A' ' 77' ' ' TYR . 43.7 t -131.72 149.18 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.134 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.831 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.8 mp -108.0 138.05 36.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.106 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 27.5 mtpp -96.92 29.4 3.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.11 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.649 ' H ' HG22 ' A' ' 8' ' ' ILE . 50.2 t-20 88.97 85.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.576 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.555 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -98.81 165.75 11.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.184 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.1 t70 -148.93 21.57 0.99 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.555 ' O ' ' HG2' ' A' ' 13' ' ' MET . 47.3 ttm -94.54 42.27 1.09 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 16' ' ' ASP . 50.0 m 68.19 111.94 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.853 0.359 . . . . 0.0 110.321 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.438 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 8.6 mp0 -33.69 -34.62 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.194 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 14' ' ' SER . 7.5 t70 -55.82 -45.22 78.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.863 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.552 ' HE1' ' CZ ' ' A' ' 50' ' ' TYR . 23.4 mmt -69.96 -22.14 63.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.757 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.826 ' HA ' HD11 ' A' ' 74' ' ' ILE . 0.7 OUTLIER -68.78 -39.57 80.14 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.189 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.62 -38.61 54.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.823 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -72.8 -54.41 8.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.433 . . . . 0.0 110.535 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.23 -49.86 70.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.284 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 18' ' ' GLN . 77.8 t -57.86 -54.66 28.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.199 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.549 ' O ' HG22 ' A' ' 26' ' ' THR . 63.2 m-20 -66.78 -26.13 66.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.805 0.336 . . . . 0.0 110.746 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 49.3 t -73.05 -29.09 62.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 78' ' ' LEU . . . -77.67 -31.83 52.79 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.346 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 23' ' ' ASP . 3.9 t -78.48 -48.73 14.75 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.155 -0.684 . . . . 0.0 109.155 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' N ' ' CG2' ' A' ' 26' ' ' THR . 11.6 mm100 -64.42 -25.6 68.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.125 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -74.96 -44.63 47.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.977 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.599 ' HE3' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -75.91 -24.07 55.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.22 -179.786 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.599 ' HG3' ' HE3' ' A' ' 29' ' ' MET . 96.5 mt-10 -77.51 -55.84 5.04 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.984 0.421 . . . . 0.0 110.021 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.81 -25.17 67.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.762 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -141.18 135.05 30.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -102.28 26.1 8.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.319 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 35' ' ' GLU . 5.6 mm -98.55 177.14 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 34' ' ' ILE . 56.2 mt-10 -115.22 0.22 13.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.662 0.268 . . . . 0.0 110.935 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 8.0 mtpm? -111.27 -47.69 3.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.272 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -59.71 -26.21 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 39.8 mm -63.85 -58.97 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.341 179.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -19.84 64.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.0 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -78.9 -43.12 25.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.98 -28.26 66.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.003 0.43 . . . . 0.0 110.015 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.4 mt -82.59 -46.59 19.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.485 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -67.88 -30.77 70.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.169 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 45.3 mmtm -79.03 -40.26 31.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.78 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.5 -42.38 87.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.031 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -82.0 -45.43 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.763 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -25.67 65.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.469 ' NZ ' ' HB2' ' A' ' 48' ' ' LYS . 4.7 ttmp? -71.06 -21.27 62.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.615 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -125.13 -4.44 7.42 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.552 ' CZ ' ' HE1' ' A' ' 17' ' ' MET . 2.8 m-85 -130.19 4.98 4.84 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.89 156.78 0.1 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 111.146 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.7 Cg_endo -60.49 174.66 1.46 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.545 2.163 . . . . 0.0 112.089 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.431 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 9.0 t -122.26 125.21 45.54 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.132 0.573 . . . . 0.0 110.884 0.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.0 m95 -117.27 -171.61 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -174.31 72.64 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.998 0.427 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.844 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -59.43 128.85 39.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.836 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.823 ' O ' HG23 ' A' ' 83' ' ' ILE . 33.3 mm -98.5 147.22 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 58' ' ' VAL . 49.1 t -127.98 65.16 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.821 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.794 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.11 -97.15 0.11 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -123.6 -83.75 0.65 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.656 0.265 . . . . 0.0 110.922 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 42.6 p-10 -152.34 10.96 0.52 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.818 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.605 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 23.2 p90 -49.24 -24.1 1.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -177.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.85 44.64 1.33 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.456 -0.878 . . . . 0.0 113.068 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.6 m -93.59 62.13 3.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -109.75 29.79 7.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.164 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.549 HG11 ' N ' ' A' ' 87' ' ' LYS . 47.6 t -118.37 -22.59 4.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.549 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.9 m -48.45 -27.69 2.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -45.7 -28.25 0.98 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.5 mm-40 -108.55 -67.51 0.97 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.219 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.466 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 11.4 m 80.47 0.6 1.92 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.901 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HG3' ' CE1' ' A' ' 72' ' ' HIS . 21.9 tptm -47.1 -28.52 1.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.196 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.506 ' CE1' ' HG3' ' A' ' 71' ' ' LYS . 67.0 m80 -157.05 93.94 1.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.395 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.568 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -120.98 152.28 38.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.235 -179.383 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.826 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -152.42 120.5 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.217 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.831 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.6 m-85 -107.68 139.26 42.5 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.921 0.391 . . . . 0.0 111.376 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 1.5 p90 -170.28 122.22 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.489 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.567 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 4.8 p90 -104.99 144.7 31.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.062 0.458 . . . . 0.0 111.526 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.417 HD11 ' CB ' ' A' ' 25' ' ' ALA . 71.3 mt -111.98 110.98 21.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.422 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -76.58 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.422 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.02 25.7 0.91 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 0.0 111.035 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.794 HG13 ' HA2' ' A' ' 59' ' ' GLY . 53.3 t -133.26 100.87 3.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.031 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.567 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -69.76 127.27 32.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.607 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.823 HG23 ' O ' ' A' ' 57' ' ' ILE . 62.5 mt -104.04 138.53 28.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.553 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.598 HD12 ' O ' ' A' ' 83' ' ' ILE . 11.0 mp -128.09 103.66 7.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.019 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.844 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.1 tp -108.31 113.31 26.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.517 ' CB ' HG11 ' A' ' 66' ' ' VAL . 9.0 m-85 -127.14 -179.19 4.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 111.565 -178.459 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.549 ' N ' HG11 ' A' ' 66' ' ' VAL . 1.5 tmtp? -151.87 98.47 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.069 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.494 ' N ' HG13 ' A' ' 66' ' ' VAL . 48.0 t -73.17 81.05 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.829 0.347 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.463 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.918 0.39 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.1 t -103.67 -175.82 2.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.008 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -158.26 82.7 0.84 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -147.8 176.46 10.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -149.24 57.29 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.129 0.49 . . . . 0.0 110.643 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.97 103.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.581 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 8' ' ' ILE . 26.6 t -153.76 163.91 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.243 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.623 HD13 ' HG3' ' A' ' 18' ' ' GLN . 58.8 mt -114.69 115.31 49.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.343 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -70.07 -41.26 74.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.272 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 48.5 t-20 179.66 74.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 0.0 110.679 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -79.18 142.63 36.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.482 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 8.8 t70 -146.78 23.55 1.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.68 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.498 ' HE2' ' O ' ' A' ' 72' ' ' HIS . 27.4 ttm -107.9 47.58 0.89 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.076 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.479 ' HB3' ' O ' ' A' ' 13' ' ' MET . 33.2 t 74.37 114.82 0.06 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.617 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 16.6 pt-20 -32.56 -35.67 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.666 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 14' ' ' SER . 65.9 t0 -54.55 -37.57 65.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.858 0.361 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.443 ' HB3' HD12 ' A' ' 74' ' ' ILE . 1.0 OUTLIER -74.71 -19.82 60.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.923 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -70.76 -45.06 65.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.826 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -78.75 -32.95 46.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.582 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.436 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.9 t70 -72.09 -46.62 56.05 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.431 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -61.08 -41.61 96.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.636 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 18' ' ' GLN . 76.6 t -57.69 -58.46 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-O 120.716 0.293 . . . . 0.0 110.587 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 55.9 m-20 -66.13 -30.39 70.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.187 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.686 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -68.67 -33.9 74.78 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.92 -25.38 37.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.678 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.6 m -74.86 -49.86 19.02 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.782 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 23' ' ' ASP . 9.1 mp0 -73.53 -24.38 60.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.613 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -68.84 -45.73 70.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.905 0.383 . . . . 0.0 110.255 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.558 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.0 mmt -79.53 -19.7 48.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.784 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -79.3 -46.45 17.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.542 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -81.07 -18.28 47.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.316 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -149.84 167.09 27.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.811 0.339 . . . . 0.0 111.35 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -156.54 45.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.993 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.524 HG21 ' OD1' ' A' ' 37' ' ' ASP . 30.2 mt -99.65 -7.06 9.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.391 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.9 mt-10 76.44 -56.07 0.57 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.954 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.488 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 7.9 mtpm? -76.76 -53.66 7.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.578 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.524 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.6 -26.81 45.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.223 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.613 HG23 ' HB1' ' A' ' 28' ' ' ALA . 48.3 mm -61.27 -52.32 62.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.279 179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.11 -26.59 62.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.047 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -77.45 -42.91 34.24 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.96 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.429 ' CE1' ' OE2' ' A' ' 45' ' ' GLU . 5.1 t80 -68.88 -31.14 69.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.069 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.686 HG23 ' SG ' ' A' ' 24' ' ' CYS . 97.2 mt -76.62 -50.65 21.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.744 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 17.9 ptpt -63.63 -35.19 79.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.514 ' C ' ' HD3' ' A' ' 44' ' ' LYS . 0.9 OUTLIER -56.41 -52.57 64.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.623 179.271 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.429 ' OE2' ' CE1' ' A' ' 41' ' ' TYR . 94.3 mt-10 -58.15 -48.68 79.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.675 0.274 . . . . 0.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.559 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -64.97 -21.13 66.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.617 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 41.8 m-20 -80.33 -34.36 36.75 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.687 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 7.7 mmpt? -90.13 13.95 13.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.541 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 6.7 ttpm? -119.43 -6.75 10.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.484 0.183 . . . . 0.0 111.329 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.452 ' CE2' ' HE2' ' A' ' 49' ' ' LYS . 51.2 m-85 -148.61 -79.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 111.07 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -177.98 135.77 0.35 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.716 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.31 169.27 22.02 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.425 2.083 . . . . 0.0 112.445 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.9 m -114.32 127.85 56.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.982 0.513 . . . . 0.0 110.844 0.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.455 ' CD1' ' OD1' ' A' ' 47' ' ' ASP . 7.9 m95 -89.02 176.06 7.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.053 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.435 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 19.9 t-80 -155.4 103.97 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.952 0.406 . . . . 0.0 110.841 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.774 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.1 t -93.83 147.37 23.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.066 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.501 HG23 ' CE1' ' A' ' 62' ' ' PHE . 6.9 mm -117.46 162.41 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.66 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.408 ' N ' HG22 ' A' ' 57' ' ' ILE . 59.1 t -147.19 87.51 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.052 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.66 -87.5 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.488 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 77.9 mtt-85 -157.99 66.54 0.47 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.946 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.465 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER 49.46 15.67 0.14 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.252 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.501 ' CE1' HG23 ' A' ' 57' ' ' ILE . 6.3 p90 -59.68 -19.03 46.9 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.521 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -54.4 -51.26 52.67 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.903 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.1 m 49.34 70.18 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.877 0.37 . . . . 0.0 110.583 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.488 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 1.6 t80 -149.65 50.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.149 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.541 ' O ' HG12 ' A' ' 66' ' ' VAL . 39.4 t -119.67 -0.88 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.069 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -107.21 -29.05 9.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.715 0.293 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.516 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 41.1 m80 -49.09 -27.47 3.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.816 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 14.4 pt-20 153.52 49.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.59 0.556 . . . . 0.0 110.9 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 44.8 m -103.1 -86.79 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.317 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 75.35 -13.86 0.82 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.65 -179.501 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.498 ' O ' ' HE2' ' A' ' 13' ' ' MET . 2.9 m-70 -123.29 81.17 1.86 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 5.7 p90 -114.29 170.95 7.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.716 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.526 HG13 ' HB1' ' A' ' 11' ' ' ALA . 7.5 tt -147.18 108.42 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.579 178.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.6 ' CD1' HD13 ' A' ' 84' ' ' LEU . 7.6 m-30 -76.64 149.87 36.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.487 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HB3' ' HB ' ' A' ' 83' ' ' ILE . 3.2 t80 -150.53 135.42 17.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.217 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 51.9 t80 -125.89 127.76 46.52 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.757 0.313 . . . . 0.0 111.459 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.651 HD12 ' N ' ' A' ' 78' ' ' LEU . 0.7 OUTLIER -126.57 109.79 12.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.795 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.41 -88.1 0.01 OUTLIER Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.768 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 16.9 mp0 -129.61 21.42 5.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 111.021 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.52 HG12 ' N ' ' A' ' 82' ' ' ALA . 53.8 t -128.16 160.76 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.737 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.52 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -130.11 115.04 16.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.785 0.326 . . . . 0.0 111.303 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.581 ' HB ' ' HB3' ' A' ' 76' ' ' PHE . 68.5 mt -95.16 125.01 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.6 HD13 ' CD1' ' A' ' 75' ' ' TYR . 52.0 tp -119.87 107.28 12.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.704 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.774 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.6 tp -106.87 150.44 26.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.941 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.488 ' CE2' ' O ' ' A' ' 65' ' ' TYR . 17.9 p90 -174.62 178.27 1.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.07 0.462 . . . . 0.0 111.508 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.462 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 5.8 tmtm? -132.76 88.87 2.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.336 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 43.3 t -73.15 69.24 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.581 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.59 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttm . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t -90.89 142.11 28.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.03 31.59 4.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.892 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -117.73 -168.65 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -133.98 57.99 1.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' HB1' HG11 ' A' ' 22' ' ' VAL . . . -171.11 84.06 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.27 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.7 t -130.79 135.34 60.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.839 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.766 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.9 mp -104.19 96.93 4.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 27.6 mtpp -60.99 -18.58 58.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 43.7 t30 172.66 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.994 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.512 ' HB3' ' CD ' ' A' ' 18' ' ' GLN . . . -156.5 138.59 14.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.008 0.433 . . . . 0.0 111.664 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.455 ' HB3' ' CE1' ' A' ' 73' ' ' PHE . 38.5 t70 -133.91 12.21 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.768 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 47.8 ttm -90.7 34.34 0.9 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.22 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.47 ' O ' ' N ' ' A' ' 16' ' ' ASP . 38.6 t 68.4 112.02 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.51 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.4 mt-10 -27.58 -39.08 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.563 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 14' ' ' SER . 1.5 m-20 -51.32 -45.64 62.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.355 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.494 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.6 mpt? -70.76 -23.24 62.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.144 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.932 ' HA ' HD11 ' A' ' 74' ' ' ILE . 63.0 mt-30 -70.8 -37.87 73.31 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -80.52 -34.57 35.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.68 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -74.93 -50.88 15.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.071 0.462 . . . . 0.0 110.404 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.5 65.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.195 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.606 HG23 ' O ' ' A' ' 18' ' ' GLN . 96.5 t -58.65 -47.67 88.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.614 0.245 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 36.5 t70 -66.63 -35.19 79.58 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.628 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.0 t -68.12 -35.2 77.75 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -77.62 -24.9 49.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.725 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -75.97 -52.89 9.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.875 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 23.5 pt20 -66.95 -26.15 66.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.969 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -65.67 -56.44 12.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.508 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.3 ptp -69.28 -18.6 63.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -82.47 -47.82 11.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.245 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -72.86 -27.96 62.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.47 ' CD2' ' OD2' ' A' ' 37' ' ' ASP . 13.1 m-85 -119.24 -170.88 2.01 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.453 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.4 t-20 -147.67 27.94 0.97 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.795 -179.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.562 HG22 ' H ' ' A' ' 35' ' ' GLU . 7.1 mt -121.21 170.7 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.562 ' H ' HG22 ' A' ' 34' ' ' ILE . 24.5 pt-20 -114.48 23.79 12.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.779 0.323 . . . . 0.0 110.977 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -124.68 -49.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.578 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.514 ' OD1' ' HB ' ' A' ' 34' ' ' ILE . 9.4 p-10 -64.09 -27.37 69.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.537 ' O ' HD13 ' A' ' 42' ' ' ILE . 34.3 mm -61.35 -57.04 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.649 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.62 -28.83 61.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.28 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -76.96 -35.14 57.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 50.8 t80 -69.38 -30.35 68.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.78 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.537 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.1 mp -84.28 -43.51 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -66.29 -31.95 73.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.939 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 73.2 mmtt -83.45 -39.45 20.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.92 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 17.5 tp10 -54.04 -47.29 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.961 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.499 ' CD2' HD21 ' A' ' 85' ' ' LEU . 56.1 m-85 -80.05 -44.41 20.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.221 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -67.0 -9.81 42.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.75 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 44' ' ' LYS . 4.1 tppp? -81.65 -27.62 34.01 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.97 41.44 0.83 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.425 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 9.1 m-85 -132.78 -86.63 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.567 0.223 . . . . 0.0 111.022 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.59 104.78 0.16 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.515 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 31.3 Cg_exo -57.46 160.28 14.32 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.195 1.93 . . . . 0.0 111.996 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.8 m -112.38 142.52 44.82 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.303 0.641 . . . . 0.0 110.621 -0.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.475 ' HB3' HD11 ' A' ' 85' ' ' LEU . 19.5 m95 -111.08 138.2 47.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.839 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 52.8 m170 -122.03 98.15 5.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.065 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HB2' HD13 ' A' ' 85' ' ' LEU . 54.0 t -82.04 142.32 32.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.568 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.853 ' O ' HG23 ' A' ' 83' ' ' ILE . 16.5 mm -117.75 142.92 29.85 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-O 120.842 0.354 . . . . 0.0 111.773 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.737 ' O ' HG13 ' A' ' 58' ' ' VAL . 12.3 p -127.71 94.57 2.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.394 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.495 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 168.19 -94.43 0.11 Allowed Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.947 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -125.22 -85.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.574 0.225 . . . . 0.0 111.604 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 33.3 p-10 -146.41 13.81 1.24 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.525 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 21.2 p90 -70.94 52.03 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 111.054 -177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.647 ' HA3' HD11 ' A' ' 84' ' ' LEU . . . -78.69 -62.0 2.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.419 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' CG ' ' A' ' 65' ' ' TYR . 21.3 m 79.58 116.58 0.06 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.565 ' CG ' ' O ' ' A' ' 64' ' ' SER . 36.1 p90 53.39 64.26 1.92 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.738 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 86' ' ' PHE . 51.8 t -94.4 -24.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.626 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 71' ' ' LYS . 87.2 m -134.82 -32.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.671 0.272 . . . . 0.0 111.555 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.72 -5.93 18.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.53 ' HG2' ' N ' ' A' ' 70' ' ' THR . 13.8 pm0 -91.01 -50.86 5.63 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.555 ' O ' ' CB ' ' A' ' 71' ' ' LYS . 4.5 t -134.4 -44.67 0.76 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.559 ' HD2' HG22 ' A' ' 67' ' ' THR . 14.2 mmmm 108.69 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.394 1.059 . . . . 0.0 110.017 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.499 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 43.8 m80 -128.54 79.21 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.581 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.627 ' O ' ' HB2' ' A' ' 13' ' ' MET . 11.0 p90 -118.7 171.64 8.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.932 HD11 ' HA ' ' A' ' 18' ' ' GLN . 12.4 tt -168.07 111.0 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.094 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.565 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.7 m-85 -97.22 154.58 17.3 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.035 0.445 . . . . 0.0 111.576 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 15.0 p90 -170.37 123.67 0.69 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.724 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -88.18 125.77 34.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.592 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.545 HD21 HG13 ' A' ' 22' ' ' VAL . 86.6 mt -123.17 132.87 54.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.218 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.99 -100.0 0.06 OUTLIER Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.792 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 6.4 pm0 -133.49 23.84 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.712 0.291 . . . . 0.0 111.014 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.495 HG13 ' HA2' ' A' ' 59' ' ' GLY . 46.9 t -140.64 137.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -90.9 128.66 36.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.077 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 57' ' ' ILE . 73.6 mt -118.85 137.44 52.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.516 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.647 HD11 ' HA3' ' A' ' 63' ' ' GLY . 0.7 OUTLIER -135.09 113.66 11.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.103 0.478 . . . . 0.0 111.47 179.622 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 56' ' ' CYS . 45.8 tp -98.99 141.05 32.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.67 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.725 ' HB3' HG13 ' A' ' 66' ' ' VAL . 8.0 p90 -156.44 139.86 15.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.448 0.642 . . . . 0.0 111.616 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.567 ' HD3' ' N ' ' A' ' 88' ' ' SER . 1.6 tmtp? -94.32 154.2 17.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.435 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.567 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 8.6 m -127.95 148.44 50.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.845 0.355 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.489 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.875 0.369 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.4 m -98.8 109.58 22.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.9 52.54 2.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -152.76 146.33 25.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.953 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -168.63 30.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 61.69 132.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.36 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.587 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 0.4 OUTLIER -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.441 ' N ' ' HG3' ' A' ' 60' ' ' ARG . 35.5 p-10 -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.815 0.34 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t 61.74 152.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.783 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -176.74 82.22 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.528 ' CG ' HG22 ' A' ' 7' ' ' VAL . 21.5 tpp180 -105.3 -18.63 14.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.144 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' N ' ' HD3' ' A' ' 5' ' ' LYS . 3.3 mppt? 63.67 86.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.979 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.37 124.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.229 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.528 HG22 ' CG ' ' A' ' 4' ' ' ARG . 42.8 t -144.46 81.38 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.138 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.594 HG21 ' HB2' ' A' ' 11' ' ' ALA . 61.1 mt -60.75 116.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.969 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -71.95 -44.39 63.66 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.634 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 43.9 t30 -153.71 116.98 4.58 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.902 0.382 . . . . 0.0 110.941 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -103.73 84.0 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.463 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 59.5 t0 -81.1 -5.21 57.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.971 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.459 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.7 tpp -92.99 162.64 13.97 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.58 0.229 . . . . 0.0 110.444 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 13' ' ' MET . 62.9 m -40.07 -74.56 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.968 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' SER . 39.6 tt0 177.71 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.527 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.515 ' HB2' ' HE1' ' A' ' 17' ' ' MET . 59.8 m-20 -56.85 -33.08 66.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.099 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.516 ' HB3' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -75.59 -26.77 58.15 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.672 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.794 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.9 mt-30 -66.33 -46.07 78.09 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -79.92 -32.55 40.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.94 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.503 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.4 t0 -72.67 -50.06 27.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB1' ' CE1' ' A' ' 76' ' ' PHE . . . -58.82 -48.83 79.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.081 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 18' ' ' GLN . 90.9 t -55.23 -53.12 38.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.917 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -71.84 -24.5 61.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.834 0.35 . . . . 0.0 110.653 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 39.1 t -72.87 -32.8 65.65 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.07 -27.55 39.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.894 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.7 m -78.2 -45.83 22.03 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 87.3 mt-30 -71.98 -24.92 61.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.355 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.827 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -76.0 -41.78 50.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.177 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -74.93 -29.82 61.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.688 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.544 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.4 pt-20 -82.38 -43.04 17.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.982 0.42 . . . . 0.0 110.135 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' O ' ' CD1' ' A' ' 32' ' ' TYR . 62.8 tttp -76.31 -21.35 56.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.743 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.425 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 54.7 m-85 -152.51 161.1 43.05 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.979 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -144.5 18.57 1.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.6 mm -75.77 -13.78 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.379 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 87.2 mt-10 74.94 -54.02 0.67 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.823 0.344 . . . . 0.0 110.772 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.406 ' NZ ' HG22 ' A' ' 34' ' ' ILE . 33.3 mtmm -69.75 -57.96 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.51 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.86 -27.22 17.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.305 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.827 HG23 ' HB1' ' A' ' 28' ' ' ALA . 49.3 mm -61.31 -54.22 38.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.438 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.14 -27.12 63.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -80.73 -38.78 28.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.762 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -70.42 -27.6 64.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.358 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.44 HG12 ' SG ' ' A' ' 24' ' ' CYS . 86.9 mt -79.55 -47.69 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.562 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -65.29 -38.45 90.26 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.4 tptm -57.02 -57.29 13.2 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.126 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -55.13 -51.24 67.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.225 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.49 ' CE2' HD22 ' A' ' 85' ' ' LEU . 39.8 m-85 -62.67 -25.38 68.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.713 0.292 . . . . 0.0 111.115 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -86.45 -25.99 24.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.158 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -89.9 -17.53 27.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.429 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -101.84 -61.14 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.701 0.286 . . . . 0.0 111.353 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -91.71 14.7 14.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.627 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 75.1 m-20 59.79 157.14 0.1 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.679 0.276 . . . . 0.0 110.94 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 51' ' ' ASN . 15.2 Cg_endo -57.3 172.63 0.86 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.533 2.155 . . . . 0.0 112.066 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 53' ' ' THR . 9.5 t -122.82 103.41 8.62 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.077 0.551 . . . . 0.0 110.819 0.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.682 ' HB3' HD11 ' A' ' 85' ' ' LEU . 4.5 m95 -102.12 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.486 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 78.1 t60 178.17 75.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.238 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.623 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.2 t -64.21 148.25 50.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.396 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.5 mm -114.68 146.18 19.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.604 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -133.23 77.22 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.769 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.524 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 177.76 -81.2 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.521 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 55.9 mtp85 -142.72 -80.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.748 0.309 . . . . 0.0 111.288 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.0 p-10 -156.3 14.43 0.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.761 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.76 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -51.66 -25.67 7.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.341 . . . . 0.0 111.263 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.34 51.96 0.84 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.023 -0.608 . . . . 0.0 111.728 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.0 p -85.78 60.48 6.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.057 0.456 . . . . 0.0 111.178 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 13.8 m-85 -89.47 30.7 0.98 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.685 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 73' ' ' PHE . 66.3 t -46.84 -77.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.9 m -53.08 -30.55 36.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.522 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -56.78 -20.98 25.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.866 0.365 . . . . 0.0 110.258 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.618 ' HG3' ' HB2' ' A' ' 88' ' ' SER . 0.3 OUTLIER -82.39 -73.62 0.39 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.357 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.843 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.5 t -175.61 -86.64 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.406 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.843 ' H ' HG23 ' A' ' 70' ' ' THR . 13.9 tptt -163.47 26.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.992 0.425 . . . . 0.0 110.373 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -122.88 75.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.585 ' HB3' HG13 ' A' ' 66' ' ' VAL . 9.3 p90 -119.23 -176.25 3.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.192 0.52 . . . . 0.0 111.858 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.516 HG21 ' HB3' ' A' ' 17' ' ' MET . 7.9 tt 177.68 111.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.421 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.634 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 9.3 p90 -123.99 147.93 47.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.289 0.566 . . . . 0.0 111.986 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.6 ' HE2' HD11 ' A' ' 78' ' ' LEU . 2.0 p90 -140.37 170.14 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.846 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.4 ' O ' HD23 ' A' ' 78' ' ' LEU . 3.1 t80 -121.21 137.72 54.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.726 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.6 HD11 ' HE2' ' A' ' 76' ' ' PHE . 84.3 mt -131.36 130.88 43.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.116 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.7 -92.09 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.806 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.523 ' OE1' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -138.46 33.82 2.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.996 0.426 . . . . 0.0 110.94 179.655 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.524 HG13 ' HA2' ' A' ' 59' ' ' GLY . 87.8 t -138.38 150.59 24.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.556 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.92 118.68 36.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.123 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.817 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.5 mp -105.07 132.97 50.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -137.61 124.51 21.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.104 0.478 . . . . 0.0 111.487 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.682 HD11 ' HB3' ' A' ' 54' ' ' TRP . 33.2 tp -119.74 137.47 53.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.876 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 2.8 p90 -137.68 152.65 49.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.181 0.515 . . . . 0.0 111.965 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.537 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 6.4 tmtm? -124.94 127.93 47.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.155 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.802 ' HA ' HG22 ' A' ' 70' ' ' THR . 29.0 t -96.22 151.3 19.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.623 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.554 179.791 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.889 0.376 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.8 p -179.17 -175.23 0.36 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.808 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -173.47 82.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.791 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -152.31 -179.31 7.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.934 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -98.08 33.13 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.439 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . -171.62 93.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.682 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 44.3 t -134.04 105.34 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.43 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.702 HD13 ' HG3' ' A' ' 18' ' ' GLN . 67.6 mt -82.58 113.94 22.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.955 0.407 . . . . 0.0 110.585 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -78.8 -34.3 45.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.955 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -169.88 110.73 0.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -125.3 137.32 54.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.974 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -140.88 2.03 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.51 ' O ' ' HG2' ' A' ' 13' ' ' MET . 50.2 ttp -94.19 58.87 2.56 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.781 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.9 t 64.18 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.02 0.438 . . . . 0.0 111.283 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.538 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -35.08 -34.51 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.853 179.615 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -50.9 -39.19 53.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.853 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.414 ' HG2' ' CE ' ' A' ' 13' ' ' MET . 0.9 OUTLIER -68.77 -25.31 64.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.245 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.702 ' HG3' HD13 ' A' ' 8' ' ' ILE . 2.8 mp0 -68.57 -42.91 77.62 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.068 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -79.05 -32.07 44.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.393 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -77.11 -50.19 13.59 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.896 0.379 . . . . 0.0 110.636 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.78 80.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.874 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -63.07 -41.05 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.726 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -68.11 -39.68 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 81.1 m -67.71 -32.78 73.66 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -78.29 -25.55 46.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.469 177.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 99.0 m -74.97 -55.24 5.97 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -65.36 -26.63 68.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.212 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.523 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -67.54 -46.55 72.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.613 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.52 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 1.6 tpt -70.06 -27.02 64.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.749 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -83.31 -43.22 16.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.027 0.442 . . . . 0.0 110.125 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -77.86 -22.54 49.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.919 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -133.79 150.05 51.43 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.741 0.305 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -116.37 29.83 7.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.022 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.711 HG22 ' H ' ' A' ' 35' ' ' GLU . 4.9 mt -123.55 176.35 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.711 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.2 mt-10 -109.18 14.73 23.7 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.775 0.321 . . . . 0.0 110.786 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.551 ' HA ' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -113.99 -58.9 2.09 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.288 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -53.52 -25.76 18.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.903 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.523 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 40.4 mm -64.0 -59.94 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.465 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.457 ' HB2' ' HB ' ' A' ' 58' ' ' VAL . . . -58.05 -29.91 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.97 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.524 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -71.69 -42.78 67.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.376 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 5.5 t80 -66.78 -27.8 67.88 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.92 0.391 . . . . 0.0 110.256 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -79.06 -50.39 18.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.184 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.524 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.2 pttm -71.23 -27.78 63.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.407 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 55.9 mtpt -71.26 -48.12 52.96 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.648 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -61.39 -37.56 83.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.734 0.302 . . . . 0.0 110.818 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.586 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.7 m-85 -83.29 -19.54 36.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.755 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.4 -36.72 16.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.72 0.295 . . . . 0.0 111.395 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 4.0 mptp? -90.27 29.21 1.28 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.363 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -145.86 -44.37 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -104.79 5.79 33.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.45 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 54.2 m-20 61.61 154.0 0.11 Allowed Pre-proline 0 C--N 1.333 -0.141 0 CA-C-O 120.766 0.317 . . . . 0.0 110.886 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 50.9 Cg_exo -54.01 174.77 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.579 2.186 . . . . 0.0 112.173 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.9 m -126.84 97.22 4.9 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 123.118 0.567 . . . . 0.0 110.455 -0.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.632 ' HB2' ' O ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -150.9 -179.08 6.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.889 -179.733 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.646 ' O ' HD12 ' A' ' 85' ' ' LEU . 19.8 p-80 -179.51 -179.63 0.54 Allowed 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 120.935 0.397 . . . . 0.0 111.043 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 31.9 p -116.91 153.33 32.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.357 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.688 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.4 mm -94.38 147.63 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.294 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.712 ' O ' HG13 ' A' ' 58' ' ' VAL . 11.4 p -122.19 72.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.534 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.77 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.52 -78.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.376 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -149.79 -82.09 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.7 0.286 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.8 p-10 -155.5 13.02 0.35 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.775 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.615 ' CE1' HG23 ' A' ' 57' ' ' ILE . 4.1 p90 -55.97 -20.29 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -129.14 50.04 0.9 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.732 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.5 m -50.11 -87.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.79 -0.241 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 58.38 61.46 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.004 0.431 . . . . 0.0 110.72 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 66' ' ' VAL . 43.8 t -116.64 -0.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.838 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -111.37 -28.1 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.777 0.322 . . . . 0.0 111.172 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.586 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 39.6 m80 -48.37 -27.73 2.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.178 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.586 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 16.6 pt-20 155.22 45.85 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.819 0.447 . . . . 0.0 110.735 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.57 HG21 HG13 ' A' ' 66' ' ' VAL . 22.9 m -92.31 -85.96 0.25 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.516 -179.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 70' ' ' THR . 31.1 mmmt 76.12 -12.32 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.074 -179.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.492 ' H ' HG22 ' A' ' 70' ' ' THR . 19.9 m80 -132.89 81.45 1.94 Allowed 'General case' 0 C--O 1.23 0.076 0 CA-C-O 120.962 0.411 . . . . 0.0 110.25 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 13' ' ' MET . 17.7 p90 -115.47 -177.08 3.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.651 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.0 tt -168.55 123.24 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.05 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.906 ' CD1' HD23 ' A' ' 84' ' ' LEU . 61.4 m-85 -101.76 137.27 40.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 1.3 p90 -159.03 117.54 2.92 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.085 0.469 . . . . 0.0 111.281 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.448 ' O ' HD23 ' A' ' 78' ' ' LEU . 48.8 t80 -84.53 136.78 33.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.924 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.548 HD12 HD12 ' A' ' 83' ' ' ILE . 90.0 mt -136.58 123.68 21.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.922 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 54.05 -106.61 0.5 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.541 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.444 ' OE1' HG23 ' A' ' 81' ' ' VAL . 1.6 pp0? -125.46 33.72 5.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 111.352 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.77 HG13 ' HA2' ' A' ' 59' ' ' GLY . 89.0 t -155.46 124.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.601 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.64 131.61 34.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.9 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.688 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.6 mt -110.02 138.72 36.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.532 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.906 HD23 ' CD1' ' A' ' 75' ' ' TYR . 2.8 tm? -135.75 115.59 13.06 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.927 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 55' ' ' HIS . 56.0 tp -96.91 136.84 36.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.605 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.632 ' O ' ' HB2' ' A' ' 54' ' ' TRP . 23.6 p90 -142.3 123.64 14.77 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.675 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 54' ' ' TRP . 1.6 tmtp? -84.96 69.3 10.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 47.6 t -76.75 63.66 2.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.539 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.3 mtp . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 120.706 0.288 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.2 m -150.0 42.89 0.87 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -85.4 57.64 4.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.709 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 51.0 mmt-85 -123.61 -168.77 1.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.742 ' O ' HD22 ' A' ' 78' ' ' LEU . 40.2 ttmt -174.69 55.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.512 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . -177.52 83.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.529 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 57.9 t -123.68 134.37 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.113 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.806 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.0 mp -112.35 101.05 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.177 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.477 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 33.3 mmtp -54.74 -23.14 16.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.87 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 45.1 t30 177.44 119.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.691 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.596 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -94.94 95.62 8.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.852 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.456 ' HB2' ' CE1' ' A' ' 73' ' ' PHE . 65.7 t0 -82.08 -33.31 29.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.153 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.533 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 50.9 tpp -78.01 162.22 26.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.713 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.424 ' N ' ' HG3' ' A' ' 13' ' ' MET . 43.0 t -39.67 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.126 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.44 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -178.5 -29.68 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.18 -34.58 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.739 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 24.0 mmt -74.9 -24.82 58.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.666 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 74' ' ' ILE . 3.2 mp0 -67.5 -45.14 76.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -81.04 -31.44 34.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.241 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 46' ' ' PHE . 10.2 t0 -77.03 -50.19 13.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.342 . . . . 0.0 110.681 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.771 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -65.57 -48.09 73.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.318 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 18' ' ' GLN . 88.7 t -62.44 -46.16 97.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 66.3 t0 -72.0 -34.87 69.22 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 121.138 -0.225 . . . . 0.0 110.702 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 48.9 t -68.9 -33.68 74.17 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.21 -27.08 53.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.523 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 92.7 m -74.96 -53.53 8.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.004 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 24.4 pt20 -68.32 -23.28 64.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.93 -47.82 56.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.915 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -72.21 -27.14 62.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.16 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -79.44 -46.25 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HG3' ' CE1' ' A' ' 32' ' ' TYR . 16.9 tppt? -82.37 -24.19 34.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.51 ' CE1' ' HG3' ' A' ' 31' ' ' LYS . 7.6 m-85 -134.77 156.24 49.2 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.844 0.354 . . . . 0.0 110.621 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -143.86 23.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.115 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.9 mm -78.07 -16.55 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.59 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 86.4 mt-10 76.71 -54.12 0.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -76.51 -50.32 14.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.357 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.407 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 66.3 t0 -56.14 -29.84 61.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.945 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.634 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.4 mm -58.01 -53.05 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.351 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.594 ' HB2' ' CG2' ' A' ' 58' ' ' VAL . . . -62.25 -24.16 67.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.947 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.14 -38.09 27.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -70.82 -24.42 62.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.536 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.429 HG21 ' SG ' ' A' ' 56' ' ' CYS . 79.6 mt -84.91 -46.27 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 43' ' ' LYS . 5.3 tmtm? -64.31 -37.71 88.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.686 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 12.2 tppt? -70.71 -56.49 6.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.436 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -49.44 -40.17 35.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.512 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.695 ' CE2' HD22 ' A' ' 85' ' ' LEU . 19.2 m-85 -68.37 -51.3 45.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.23 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -68.62 -9.82 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.455 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -59.67 -28.32 67.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.502 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -164.07 32.14 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 3.4 m-85 -125.85 10.65 7.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.621 0.248 . . . . 0.0 111.196 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 62.99 134.64 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.785 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HB2' ' HB ' ' A' ' 53' ' ' THR . 54.8 Cg_endo -70.11 166.89 26.53 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.329 2.019 . . . . 0.0 112.099 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' A' ' 52' ' ' PRO . 8.8 t -130.75 122.35 27.09 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.234 0.614 . . . . 0.0 110.638 -0.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 54' ' ' TRP . 6.1 m95 -100.12 160.3 14.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.256 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 39.5 m80 -131.58 62.38 1.63 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.449 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.4 t -55.53 106.95 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.834 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.789 ' O ' HG23 ' A' ' 83' ' ' ILE . 25.1 mm -82.29 153.93 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.819 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.594 ' CG2' ' HB2' ' A' ' 39' ' ' ALA . 60.6 t -141.15 68.07 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.93 0.395 . . . . 0.0 110.739 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -174.33 -76.93 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.574 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.9 mtp85 -149.84 -77.91 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.725 0.298 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -154.96 14.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.608 -179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.542 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 28.3 p90 -56.98 -16.31 6.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.13 51.58 0.85 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.507 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.654 ' O ' HG23 ' A' ' 66' ' ' VAL . 45.9 t -44.7 -76.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.316 . . . . 0.0 111.631 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 42.59 31.57 0.3 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.489 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.672 HG21 ' OH ' ' A' ' 75' ' ' TYR . 45.2 t -97.53 -2.84 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.8 m -114.01 -27.41 7.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.822 0.344 . . . . 0.0 111.09 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.577 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 25.5 t-80 -48.28 -27.86 2.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 15.5 pt-20 157.13 44.75 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.422 0.452 . . . . 0.0 111.396 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.748 HG22 ' H ' ' A' ' 72' ' ' HIS . 73.8 m -86.77 -81.89 0.22 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.333 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 70' ' ' THR . 46.7 mmtm 75.91 -3.73 2.51 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.649 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.748 ' H ' HG22 ' A' ' 70' ' ' THR . 0.3 OUTLIER -156.48 92.87 1.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.188 0.518 . . . . 0.0 110.716 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.502 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 8.3 p90 -122.62 -170.86 2.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.135 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.71 HD12 ' OE1' ' A' ' 18' ' ' GLN . 5.5 tt -162.42 110.94 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.567 178.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.806 ' O ' HG23 ' A' ' 8' ' ' ILE . 10.7 m-30 -99.51 140.12 34.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.457 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.771 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.1 p90 -170.17 127.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.101 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.529 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 8.3 p90 -114.47 145.98 41.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.212 0.53 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.742 HD22 ' O ' ' A' ' 5' ' ' LYS . 81.7 mt -115.58 117.59 30.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.495 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -77.31 0.2 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.413 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.56 24.93 0.87 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.1 t -134.14 118.5 28.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.873 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.515 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -92.04 122.78 34.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 112.063 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.789 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.3 mp -100.47 133.29 44.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.187 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.73 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.4 mp -120.1 97.99 5.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 111.569 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.695 HD22 ' CE2' ' A' ' 46' ' ' PHE . 49.8 tp -98.69 134.62 41.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.692 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.502 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 7.0 p90 -171.89 163.96 6.32 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.626 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HB3' ' NE2' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -113.77 81.21 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.609 179.109 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 89.3 p -69.02 67.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.843 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.34 -1.256 . . . . 0.0 112.52 179.889 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.875 0.369 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.4 m -98.8 109.58 22.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.9 52.54 2.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -152.76 146.33 25.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.953 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -168.63 30.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 61.69 132.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.36 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.587 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 0.4 OUTLIER -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.441 ' N ' ' HG3' ' A' ' 60' ' ' ARG . 35.5 p-10 -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtm . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.977 0.418 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.4 p -67.53 132.48 47.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.006 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 61.34 32.89 19.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.015 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -73.25 -73.12 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.954 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 5' ' ' LYS . 37.9 ttpt -164.9 31.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.614 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 179.35 97.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.09 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.2 t -135.14 90.74 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.689 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -80.88 91.09 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 66.8 mttm -58.79 -20.09 46.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.541 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 19.9 t-20 173.47 129.66 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.675 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.45 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -146.62 128.74 15.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -131.73 2.91 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 55.8 ttp -96.47 62.57 2.05 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.934 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 t 64.56 110.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.44 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.511 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.0 mt-10 -40.45 -32.77 0.21 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.246 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -53.94 -35.07 61.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.403 ' HB2' HD12 ' A' ' 74' ' ' ILE . 26.2 mmt -70.91 -24.42 62.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 3.5 mp0 -71.04 -41.11 71.24 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -77.8 -33.41 52.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.751 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -76.3 -52.52 9.81 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 120.971 0.415 . . . . 0.0 110.668 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.85 -49.94 75.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' GLN . 94.4 t -60.37 -51.37 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.46 -29.28 69.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.74 0.305 . . . . 0.0 110.453 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 46.4 t -71.66 -32.3 67.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.44 -23.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.026 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.0 m -80.56 -44.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -74.45 -28.08 60.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.252 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -74.13 -50.18 20.54 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 179.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.4 tpt -68.46 -25.96 65.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.616 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -80.64 -47.22 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.065 0.459 . . . . 0.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -73.88 -25.03 59.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.678 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -144.28 152.27 40.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.818 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -136.93 46.22 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 33.7 mt -98.18 -16.69 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.432 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 46.1 mm-40 77.94 -54.84 0.51 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.864 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -74.42 -52.93 10.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -55.75 -29.36 59.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.28 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.423 HG23 ' HB1' ' A' ' 28' ' ' ALA . 47.5 mm -60.07 -50.05 81.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.713 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.6 -20.94 63.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.201 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -82.68 -40.52 20.56 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.832 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -70.76 -26.23 63.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.194 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 85.3 mt -83.41 -46.22 18.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 35.2 ttmt -63.81 -37.69 88.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.267 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 12.8 mmmm -75.23 -31.86 60.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -58.96 -58.89 6.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.72 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.441 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 46.5 m-85 -69.91 -30.71 68.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 62.7 t0 -64.65 -34.12 77.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.964 0.411 . . . . 0.0 110.96 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.551 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -90.27 30.43 1.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.816 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -152.75 -43.49 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.352 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.57 0.45 15.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.757 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 5.3 m120 62.71 156.82 0.12 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.711 0.291 . . . . 0.0 111.287 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.429 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 11.2 Cg_endo -54.49 173.52 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.862 2.375 . . . . 0.0 112.212 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.429 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 89.7 m -117.8 128.16 54.59 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.226 0.611 . . . . 0.0 110.463 -0.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.662 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 3.1 m95 -119.3 -168.67 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.053 0.454 . . . . 0.0 111.047 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -168.25 63.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.407 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.894 ' SG ' HD13 ' A' ' 85' ' ' LEU . 60.1 m -48.4 138.34 10.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.113 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.796 ' O ' HG23 ' A' ' 83' ' ' ILE . 20.0 mm -114.48 140.99 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.743 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.1 76.95 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.95 179.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.74 -66.93 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.284 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.763 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 99.4 mtt180 -154.97 -80.9 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.741 0.305 . . . . 0.0 111.057 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.6 p-10 -160.92 17.88 0.12 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.324 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.684 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 25.1 p90 -52.8 -20.7 3.42 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 65' ' ' TYR . . . -58.52 -60.59 8.66 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.158 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p 49.6 26.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 13.8 m-30 -111.81 41.37 1.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.922 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.55 HG21 ' OH ' ' A' ' 75' ' ' TYR . 49.0 t -75.53 -71.34 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.815 0.34 . . . . 0.0 111.301 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.5 m -76.97 -28.65 55.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.219 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.401 ' ND1' ' O ' ' A' ' 68' ' ' HIS . 26.1 t-80 -54.63 -21.05 9.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.198 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 88' ' ' SER . 10.3 pt-20 -110.01 -55.23 2.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.478 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.645 HG22 ' N ' ' A' ' 71' ' ' LYS . 28.3 m -162.89 -101.71 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.074 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.645 ' N ' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 179.95 25.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.789 0.328 . . . . 0.0 111.383 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.457 ' O ' ' HA ' ' A' ' 86' ' ' PHE . 40.5 m80 -107.83 68.02 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.967 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 13' ' ' MET . 36.7 p90 -107.04 -174.99 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.216 0.532 . . . . 0.0 111.425 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.585 HG23 ' O ' ' A' ' 74' ' ' ILE . 12.2 tt -169.65 109.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.5 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.55 ' OH ' HG21 ' A' ' 66' ' ' VAL . 56.1 m-85 -89.83 138.85 31.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.762 0.315 . . . . 0.0 111.186 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.642 ' CZ ' HG22 ' A' ' 83' ' ' ILE . 1.9 p90 -166.39 112.13 0.83 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 0.0 110.824 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -91.88 129.36 37.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.3 mt -119.29 134.94 54.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 0.0 111.211 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.18 -103.92 0.14 Allowed Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.798 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.65 ' NE2' HG23 ' A' ' 81' ' ' VAL . 2.0 pp0? -128.12 33.04 4.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.921 0.391 . . . . 0.0 111.189 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.65 HG23 ' NE2' ' A' ' 80' ' ' GLN . 88.6 t -146.06 140.64 21.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.581 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.763 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -93.25 131.69 38.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.796 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.796 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.0 mt -127.4 132.54 69.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.455 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.655 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -144.78 127.38 16.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.056 0.455 . . . . 0.0 111.579 -179.442 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.894 HD13 ' SG ' ' A' ' 56' ' ' CYS . 29.8 tp -109.11 141.04 41.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.602 ' H ' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -157.97 154.73 28.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.003 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.662 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -140.41 154.18 46.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.013 0.435 . . . . 0.0 111.688 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 92.9 p -81.28 76.86 8.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.079 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.516 ' HA3' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.329 -1.262 . . . . 0.0 112.766 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.2 mtm . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.1 m -150.21 155.34 39.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.884 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 54.2 p-10 -163.96 75.56 0.33 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.009 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 74.8 mtt-85 -80.78 -46.71 14.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.719 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp 59.56 80.4 0.2 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 63.48 128.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.45 HG12 ' HE2' ' A' ' 9' ' ' LYS . 46.2 t -144.36 88.68 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.028 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.575 HD13 ' HG3' ' A' ' 18' ' ' GLN . 79.5 mt -59.41 129.15 21.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 7' ' ' VAL . 75.2 mmtt -112.02 -23.11 10.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.188 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -165.48 85.6 0.37 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.882 0.372 . . . . 0.0 110.863 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.431 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -106.97 95.69 5.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.878 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.51 -11.16 59.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.368 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.484 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 43.4 tpp -78.34 158.73 28.72 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.708 0.29 . . . . 0.0 110.735 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -41.63 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.205 -179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.476 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 44.7 tt0 -178.27 -31.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.58 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -55.42 -32.17 62.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.844 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.484 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.1 mpt? -77.24 -24.84 51.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.563 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.662 ' OE1' HD12 ' A' ' 74' ' ' ILE . 2.0 mp0 -66.67 -45.46 78.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.21 -32.1 29.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.308 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.7 t0 -75.35 -47.55 27.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 110.656 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -66.45 -49.14 67.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.139 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 18' ' ' GLN . 86.2 t -60.23 -41.61 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.79 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -77.12 -31.68 55.93 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.625 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 37.9 t -72.07 -29.81 64.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.1 -26.89 33.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.977 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.3 m -78.9 -45.78 19.85 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.728 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -72.35 -28.35 62.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.743 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -67.53 -56.17 10.59 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.391 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 67.1 mtm -70.11 -20.15 63.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.643 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -81.14 -45.03 17.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -83.78 -26.33 29.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.7 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -137.65 170.03 16.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.492 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 0.4 OUTLIER -154.48 54.79 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 21.4 mt -108.11 -11.11 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.477 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 7.9 mp0 72.69 -54.47 0.69 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.093 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -75.69 -50.23 16.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.406 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 7.6 t70 -57.16 -29.1 63.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.418 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.743 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.6 mm -60.9 -49.79 83.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.476 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.78 -23.66 63.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.474 ' HA ' ' HG3' ' A' ' 43' ' ' LYS . . . -75.99 -45.09 36.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.195 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.4 t80 -67.68 -25.82 65.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.902 0.382 . . . . 0.0 110.391 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.6 mt -80.92 -49.46 18.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.908 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.531 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -68.33 -31.48 70.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.072 179.068 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 29.7 mmmt -72.51 -42.32 64.94 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.316 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -70.35 -27.88 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.437 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.501 ' CD2' HD21 ' A' ' 85' ' ' LEU . 32.2 m-85 -89.01 -38.87 14.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.539 0.209 . . . . 0.0 111.502 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.62 -25.43 49.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.0 111.175 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -87.17 -11.97 48.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.193 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -110.22 -53.68 2.65 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.665 0.269 . . . . 0.0 111.21 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 52.5 m-85 -94.97 16.54 15.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.637 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.412 ' OD1' ' HD2' ' A' ' 52' ' ' PRO . 45.6 t30 62.61 138.68 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.55 0.214 . . . . 0.0 110.851 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OD1' ' A' ' 51' ' ' ASN . 53.2 Cg_exo -55.52 172.49 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.248 1.965 . . . . 0.0 112.125 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.0 m -120.97 125.61 47.82 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.134 0.574 . . . . 0.0 110.789 0.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.452 ' CZ2' ' HG3' ' A' ' 87' ' ' LYS . 8.9 m95 -114.08 174.36 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.516 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.408 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 92.2 m-70 -157.52 92.58 1.23 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.078 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.888 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -79.24 137.71 37.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.534 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.844 ' O ' HG23 ' A' ' 83' ' ' ILE . 13.8 mm -112.73 145.88 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 120.748 0.308 . . . . 0.0 111.508 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.1 p -123.61 75.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.684 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.711 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -178.06 -88.95 0.07 OUTLIER Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.735 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -135.29 -84.16 0.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.641 0.258 . . . . 0.0 111.318 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 39.3 p-10 -151.11 12.79 0.67 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.651 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.6 p90 -60.01 -14.86 18.26 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.432 ' HA3' ' CD1' ' A' ' 57' ' ' ILE . . . -117.14 43.47 1.63 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.013 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.7 p -97.12 63.72 1.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.887 0.375 . . . . 0.0 110.635 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -119.99 45.15 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.54 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.831 HG13 ' HB3' ' A' ' 88' ' ' SER . 97.4 t -130.82 -38.22 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.898 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -49.61 -27.31 4.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.32 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 79.1 t60 -81.92 5.97 17.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.869 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 17.5 tp10 -114.61 -33.91 5.38 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.784 0.325 . . . . 0.0 111.456 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.771 HG22 ' HD3' ' A' ' 71' ' ' LYS . 18.9 m -158.96 -95.97 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.887 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.771 ' HD3' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 156.36 2.23 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 178.549 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.426 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 20.3 m80 -79.2 60.96 3.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.162 0.506 . . . . 0.0 109.93 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 40.3 p90 -111.83 -168.14 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.926 -178.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.662 HD12 ' OE1' ' A' ' 18' ' ' GLN . 7.1 tt -168.57 148.99 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.265 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -128.19 153.15 47.22 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.006 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.672 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 19.0 p90 -170.2 123.96 0.72 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.358 0.599 . . . . 0.0 111.354 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -84.41 118.81 24.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.154 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 6' ' ' ALA . 85.6 mt -116.32 117.63 30.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.716 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.48 -105.75 0.79 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.338 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.64 ' NE2' HG23 ' A' ' 81' ' ' VAL . 1.9 pp0? -126.36 30.19 5.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 111.269 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.711 HG13 ' HA2' ' A' ' 59' ' ' GLY . 85.2 t -142.53 133.81 24.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.37 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.53 118.51 31.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.844 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.6 mp -103.11 137.04 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.009 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.677 HD12 ' CZ ' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -137.31 116.22 12.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.168 0.509 . . . . 0.0 111.899 -179.378 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.888 HD13 ' HB2' ' A' ' 56' ' ' CYS . 63.9 tp -107.18 135.27 48.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.364 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.677 ' CZ ' HD12 ' A' ' 84' ' ' LEU . 1.5 m-85 -130.75 176.12 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 0.0 112.24 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.452 ' HG3' ' CZ2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -141.82 85.62 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.474 179.433 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.831 ' HB3' HG13 ' A' ' 66' ' ' VAL . 99.1 p -71.07 108.0 4.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.818 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' ' HG3' ' A' ' 69' ' ' GLU . . . . . . . . 0 C--O 1.249 1.08 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.558 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.4 mtp . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.855 0.36 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 t -146.98 68.36 1.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.822 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -108.57 39.5 1.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 63.4 mtt85 -149.63 177.01 10.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -135.4 42.79 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.833 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -176.32 82.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.896 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.526 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 24.0 t -133.14 152.13 35.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.61 HD11 ' CG2' ' A' ' 22' ' ' VAL . 37.5 mt -115.74 114.95 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.509 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -75.02 -38.24 61.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.1 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.614 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 0.9 OUTLIER -164.0 119.0 1.54 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.851 0.358 . . . . 0.0 110.73 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -143.89 140.03 29.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.373 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -131.9 7.68 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.619 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 52.2 tpp -72.0 62.96 0.47 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.981 0.42 . . . . 0.0 111.409 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 42.2 t 68.34 -63.22 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.414 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.563 ' HB2' ' O ' ' A' ' 14' ' ' SER . 41.2 tt0 150.56 -49.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.702 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -52.89 -24.87 10.08 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.873 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.8 mpt? -81.85 -25.22 35.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.28 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.679 ' O ' HG23 ' A' ' 22' ' ' VAL . 34.8 mt-30 -65.75 -42.27 91.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 65.8 tt0 -74.94 -39.79 61.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.185 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.58 -53.81 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.908 0.385 . . . . 0.0 110.764 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.55 -51.48 65.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.309 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 18' ' ' GLN . 70.7 t -56.46 -53.76 36.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -68.46 -23.26 64.57 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.854 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.5 t -72.6 -34.09 67.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.72 -27.06 44.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.827 178.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.524 HG22 ' OE2' ' A' ' 30' ' ' GLU . 89.9 m -77.06 -49.28 15.69 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.954 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -69.67 -25.6 63.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.285 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.572 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -72.63 -42.04 64.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.535 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.6 ttm -71.5 -31.26 66.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.738 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.524 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.2 mt-10 -79.35 -46.78 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.264 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -77.04 -21.47 54.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.405 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 50.8 m-85 -144.37 149.43 36.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.842 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -136.85 43.22 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.029 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.6 mt -99.43 -16.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.418 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.4 mt-10 77.55 -54.81 0.53 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.005 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -75.33 -50.84 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.256 179.577 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.84 -28.12 54.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.08 0.467 . . . . 0.0 110.112 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -61.94 -57.87 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.416 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.15 -24.46 58.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.926 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -77.81 -42.45 33.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.017 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -69.41 -21.91 63.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.3 mt -81.62 -50.36 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.503 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 18.6 ptpt -66.17 -38.64 88.55 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.662 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 1.1 mptm? -65.53 -45.87 81.77 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.58 -44.44 76.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -74.34 -32.47 62.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.389 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.406 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 47.5 m-20 -74.32 -26.69 60.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.698 0.285 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -88.74 -15.62 34.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.512 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -111.96 -26.94 8.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.537 0.208 . . . . 0.0 111.311 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -117.96 1.94 12.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.538 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 61.73 153.46 0.11 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.69 0.281 . . . . 0.0 111.005 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 170.91 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.643 2.229 . . . . 0.0 112.145 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -117.74 119.89 36.29 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.05 0.54 . . . . 0.0 110.294 -0.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.608 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 21.9 m95 -108.63 -172.28 2.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.227 0.537 . . . . 0.0 111.596 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.433 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 15.3 t-160 -171.77 115.44 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.911 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -102.09 145.58 29.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.954 0.407 . . . . 0.0 111.33 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.867 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 27.3 mm -111.71 143.13 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.603 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.673 ' O ' HG13 ' A' ' 58' ' ' VAL . 7.2 p -129.88 58.91 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.566 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -148.02 -109.74 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.859 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 37.6 mmt180 -123.43 -65.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.86 0.362 . . . . 0.0 111.38 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -155.06 20.81 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.55 -179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 15.0 p90 -76.32 17.04 0.39 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.562 -177.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.422 ' HA3' HG13 ' A' ' 57' ' ' ILE . . . -87.63 28.69 5.73 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.016 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -71.87 57.71 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.258 0.552 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.568 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 65.9 t80 -146.28 24.53 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.347 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.769 HG11 ' HB3' ' A' ' 73' ' ' PHE . 43.6 t -85.96 -54.99 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.774 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 89.5 m -50.91 -32.8 21.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.055 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -54.57 -23.41 16.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.217 0.532 . . . . 0.0 109.728 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.532 ' HB3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -93.71 -76.34 0.48 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.219 179.06 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.837 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -163.45 -107.95 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.818 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.527 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -153.2 32.21 0.47 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.001 0.429 . . . . 0.0 110.899 179.298 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.443 ' C ' ' HE2' ' A' ' 13' ' ' MET . 37.9 m170 -109.24 72.16 0.8 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.451 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.769 ' HB3' HG11 ' A' ' 66' ' ' VAL . 30.5 p90 -106.04 -172.14 2.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.293 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.677 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.1 tt 166.37 107.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.007 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.614 ' CE2' ' HB3' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -119.24 163.68 16.75 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.162 0.506 . . . . 0.0 111.619 178.855 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 7' ' ' VAL . 5.9 p90 -155.09 162.49 41.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.742 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -119.3 133.46 55.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.053 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.909 ' O ' HD12 ' A' ' 78' ' ' LEU . 2.9 pp -140.47 141.0 35.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.979 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.57 -97.25 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.636 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -141.19 29.62 1.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.914 179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -140.72 133.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.862 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.608 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -100.0 128.62 46.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.01 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 57' ' ' ILE . 65.9 mt -115.51 138.26 46.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.629 ' C ' HD23 ' A' ' 84' ' ' LEU . 5.4 tt -130.18 117.04 19.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.612 -179.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.539 ' HB3' HG23 ' A' ' 74' ' ' ILE . 66.1 tp -109.7 144.17 38.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.553 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.665 ' CG ' HG22 ' A' ' 66' ' ' VAL . 3.8 p90 -165.06 179.79 6.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.608 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -168.85 -177.98 3.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.132 0.491 . . . . 0.0 111.752 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.837 ' HA ' HG22 ' A' ' 70' ' ' THR . 78.5 p -111.57 76.66 0.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.249 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.478 ' N ' ' HD3' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.511 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.806 0.336 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p 50.4 -175.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -162.57 85.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.9 mtt85 -152.57 -175.77 5.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.612 ' HE3' ' HA ' ' A' ' 5' ' ' LYS . 1.5 tpmt? -168.79 97.48 0.38 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 66.73 101.04 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.08 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -141.06 104.72 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.695 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -81.81 91.63 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.916 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -57.16 -19.18 18.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.722 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 49.5 t30 179.17 130.96 0.08 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.359 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -120.92 130.66 53.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.594 -179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -132.58 3.39 3.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.451 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.653 ' HE2' ' HG2' ' A' ' 17' ' ' MET . 68.3 mmm -97.45 49.07 1.04 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.028 0.442 . . . . 0.0 111.669 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.488 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 51.1 m 70.48 -63.05 0.42 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.715 178.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.668 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 10.2 pt-20 159.23 -42.25 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.651 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -52.5 -33.2 43.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.995 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.653 ' HG2' ' HE2' ' A' ' 13' ' ' MET . 1.1 mpt? -72.64 -28.29 62.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.199 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.769 ' HA ' HD11 ' A' ' 74' ' ' ILE . 55.8 mm-40 -63.26 -50.14 71.31 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.54 -34.02 64.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.081 179.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 39.1 t70 -74.89 -64.18 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 110.463 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -49.3 -46.26 46.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.32 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 18' ' ' GLN . 53.8 t -59.29 -54.61 31.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.984 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.76 -29.07 69.89 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.636 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.8 m -71.32 -34.0 70.17 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -28.45 51.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.62 178.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.604 HG22 ' OE2' ' A' ' 30' ' ' GLU . 86.7 m -74.58 -51.39 14.71 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.609 179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.448 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -68.1 -23.96 64.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.367 178.908 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.557 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.5 -46.57 63.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 93.6 mmm -70.45 -29.83 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.968 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.604 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.6 mt-10 -78.39 -47.71 17.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.356 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -75.8 -21.23 57.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.75 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -140.76 140.1 34.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.858 0.361 . . . . 0.0 111.03 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -111.02 29.28 7.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.5 mt -116.46 172.27 4.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.609 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.3 mt-10 -111.03 15.12 21.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.712 0.291 . . . . 0.0 111.296 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -119.48 -52.96 2.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.836 0.35 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.81 -23.51 52.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.012 0.434 . . . . 0.0 109.912 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.557 HG23 ' HB1' ' A' ' 28' ' ' ALA . 37.3 mm -65.57 -57.34 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.681 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.67 62.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -83.86 -41.55 17.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.966 0.412 . . . . 0.0 110.959 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.453 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -73.35 -22.55 60.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -86.39 -43.05 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.381 0.61 . . . . 0.0 109.459 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.532 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -71.66 -37.09 70.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.728 179.111 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.5 mttt -75.7 -44.03 44.21 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.3 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . 37.6 tt0 -61.69 -36.48 81.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.9 m-85 -74.92 -40.62 60.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.64 0.257 . . . . 0.0 111.517 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.99 -14.46 60.23 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 45' ' ' GLU . 4.0 ptpp? -82.91 3.94 27.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.929 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -152.25 -44.79 0.1 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.444 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -78.69 -4.1 47.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.372 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 62.99 141.62 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.707 0.289 . . . . 0.0 110.709 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.9 170.67 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.366 2.044 . . . . 0.0 112.163 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 53' ' ' THR . 7.6 t -120.97 111.51 17.59 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.089 0.556 . . . . 0.0 110.576 -0.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 10.3 m95 -101.46 168.49 9.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.06 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -151.81 99.48 2.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.758 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.885 ' HB3' HD13 ' A' ' 85' ' ' LEU . 29.4 p -90.78 130.0 36.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.84 ' O ' HG23 ' A' ' 83' ' ' ILE . 11.9 mm -109.3 149.6 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 49.0 t -134.79 90.07 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.984 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.466 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 175.56 -74.12 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.332 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 56.0 mtp85 -153.11 -78.64 0.11 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.887 0.375 . . . . 0.0 111.279 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 37.7 p-10 -162.01 24.22 0.11 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.758 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.504 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.8 p90 -67.83 8.58 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -64.95 -67.01 2.19 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.282 -0.961 . . . . 0.0 111.945 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 24.9 m 78.55 41.04 0.11 Allowed 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.416 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 5.3 p90 -179.31 65.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.807 0.337 . . . . 0.0 111.026 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.606 HG21 ' OH ' ' A' ' 75' ' ' TYR . 44.6 t -97.58 -63.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.202 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -90.71 -27.94 18.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.905 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -52.68 -22.2 4.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.311 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' HG22 ' A' ' 70' ' ' THR . 22.5 pt-20 -90.44 -59.56 2.15 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.225 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.674 HG22 ' HA ' ' A' ' 88' ' ' SER . 4.6 t -147.4 -112.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 179.042 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.644 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -166.58 33.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.078 0.466 . . . . 0.0 110.261 179.466 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -120.48 76.36 1.18 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.129 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.518 ' C ' ' HG2' ' A' ' 13' ' ' MET . 30.9 p90 -126.99 151.07 49.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.673 -178.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -133.6 128.43 54.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 178.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.606 ' OH ' HG21 ' A' ' 66' ' ' VAL . 32.5 m-85 -112.74 138.91 48.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.227 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.532 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.7 p90 -162.88 129.64 3.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.235 0.541 . . . . 0.0 110.955 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.572 ' O ' HD23 ' A' ' 78' ' ' LEU . 33.1 t80 -92.36 150.15 21.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 77' ' ' TYR . 90.5 mt -149.21 130.5 14.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.937 0.399 . . . . 0.0 111.104 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.08 -98.47 0.03 OUTLIER Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.916 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -136.14 31.87 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 0.0 110.85 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.466 HG13 ' HA2' ' A' ' 59' ' ' GLY . 60.8 t -148.61 137.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.972 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -97.43 133.96 41.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.022 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.84 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.1 mt -117.78 138.14 49.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.478 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.618 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -133.93 103.41 5.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 0.0 111.368 -179.807 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.885 HD13 ' HB3' ' A' ' 56' ' ' CYS . 44.8 tp -96.39 108.46 20.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.594 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.49 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.6 p90 -132.81 142.75 49.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.182 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.528 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -123.24 150.99 42.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.627 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.674 ' HA ' HG22 ' A' ' 70' ' ' THR . 82.7 p -93.64 165.36 12.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.525 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.7 mtp . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.796 0.332 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.4 p -60.33 119.72 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.919 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -149.69 79.87 1.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.933 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -130.33 28.2 4.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -104.06 31.44 4.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HB1' HG13 ' A' ' 22' ' ' VAL . . . 63.53 134.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.135 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.4 t -149.7 153.69 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.006 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.714 HD13 ' OE1' ' A' ' 18' ' ' GLN . 59.6 mt -130.42 115.79 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.043 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.03 -30.65 34.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.711 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -159.03 133.37 7.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -116.98 128.57 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.134 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -122.32 -16.01 7.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.523 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 17' ' ' MET . 50.3 tpp -88.53 50.56 1.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.106 0.479 . . . . 0.0 111.822 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.63 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 49.7 m 67.79 -65.25 0.25 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.821 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.696 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 tm-20 166.74 -36.18 0.0 OUTLIER 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.567 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 17' ' ' MET . 2.7 p30 -51.35 -40.78 59.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.805 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.54 ' HB2' ' HG2' ' A' ' 13' ' ' MET . 44.8 ttm -72.24 -18.59 61.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.503 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.714 ' OE1' HD13 ' A' ' 8' ' ' ILE . 71.8 mm-40 -66.51 -48.4 69.91 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -69.8 -38.61 76.68 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.863 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -72.15 -63.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.211 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.15 -44.92 32.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.316 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.642 HG13 ' HB1' ' A' ' 6' ' ' ALA . 55.4 t -60.6 -53.31 50.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.035 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.71 -29.85 71.03 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.694 0.283 . . . . 0.0 110.733 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.1 m -71.78 -31.46 66.63 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -83.44 -24.31 31.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.056 178.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.1 m -80.68 -42.57 21.8 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -75.36 -29.0 59.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.064 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.748 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.85 -47.24 60.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.523 179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.493 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.4 mmt -74.3 -23.61 59.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.763 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -77.37 -51.12 11.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.4 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -81.34 -24.78 36.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.083 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -135.35 168.85 18.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -159.14 44.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.066 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG21 ' OD2' ' A' ' 37' ' ' ASP . 31.5 mt -96.83 -16.68 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.5 mt-10 79.38 -53.07 0.42 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.095 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -79.6 -42.36 25.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.615 0.245 . . . . 0.0 110.863 -179.433 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.609 ' OD2' HG21 ' A' ' 34' ' ' ILE . 52.6 m-20 -68.86 -17.99 64.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.022 0.439 . . . . 0.0 110.222 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.748 HG23 ' HB1' ' A' ' 28' ' ' ALA . 43.5 mm -72.38 -54.06 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.4 -26.93 63.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.978 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -78.16 -38.11 44.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.61 -24.69 64.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.968 0.413 . . . . 0.0 110.341 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.3 mt -77.84 -53.28 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.755 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 64.7 pttt -66.02 -35.88 81.75 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.657 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 14.0 tppt? -61.66 -47.23 86.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -58.75 -52.47 65.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.265 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.452 ' CE2' ' HG3' ' A' ' 17' ' ' MET . 13.2 m-85 -67.77 -29.44 68.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -70.7 -26.62 63.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.021 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' NZ ' ' HB3' ' A' ' 48' ' ' LYS . 7.2 ttpm? -89.85 -27.47 19.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -95.55 -50.45 4.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.144 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -91.67 9.3 32.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.371 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 60.69 154.25 0.1 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-O 120.782 0.325 . . . . 0.0 110.901 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 172.12 1.82 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.571 2.181 . . . . 0.0 112.055 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.573 ' O ' HG23 ' A' ' 53' ' ' THR . 9.0 t -121.96 97.11 5.33 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.957 0.503 . . . . 0.0 110.651 -0.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.456 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 13.6 m95 -90.46 172.16 8.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 77.5 t60 -155.06 105.26 2.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.588 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.0 t -75.48 145.96 41.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.164 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 62' ' ' PHE . 35.9 mm -111.89 145.46 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.885 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.752 ' O ' HG13 ' A' ' 58' ' ' VAL . 9.6 p -133.53 63.82 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 121.246 0.546 . . . . 0.0 111.503 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -157.1 -92.47 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.448 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -125.75 -84.85 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.715 0.293 . . . . 0.0 111.088 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.9 p-10 -158.72 15.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.47 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 57' ' ' ILE . 9.7 p90 -53.97 -46.13 71.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.826 0.346 . . . . 0.0 111.353 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.47 ' HA3' HG23 ' A' ' 66' ' ' VAL . . . 79.47 -21.28 4.51 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.626 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 26.3 t 70.69 -53.43 0.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.915 0.358 . . . . 0.0 111.123 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -164.88 69.66 0.16 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.124 0.487 . . . . 0.0 111.256 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.612 HG22 ' CD2' ' A' ' 86' ' ' PHE . 42.1 t -91.26 -74.95 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.326 -179.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.8 m -43.6 -29.4 0.48 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.522 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 29.1 m80 -44.97 -26.77 0.46 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 12.2 pt-20 167.43 50.14 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.97 0.414 . . . . 0.0 111.158 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.547 HG21 HG13 ' A' ' 66' ' ' VAL . 35.7 m -102.93 -86.89 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.444 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.1 OUTLIER 72.44 -18.24 0.34 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.333 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.461 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 2.9 m-70 -122.23 77.33 1.39 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.738 0.304 . . . . 0.0 110.286 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.438 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 6.4 p90 -125.43 -172.27 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.047 0.451 . . . . 0.0 111.434 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.525 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.5 tt -157.8 129.7 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.259 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.682 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.2 m-30 -106.63 130.78 54.32 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.518 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.475 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.8 p90 -152.73 123.26 7.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.238 0.542 . . . . 0.0 111.411 179.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -93.2 140.7 29.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.721 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.677 HD23 ' N ' ' A' ' 78' ' ' LEU . 1.3 pt? -154.17 138.04 16.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.97 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.89 -100.82 0.59 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.541 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -140.99 23.68 2.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.737 0.303 . . . . 0.0 111.003 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 61.1 t -150.78 150.02 13.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.125 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.76 130.47 44.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.018 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.611 HG23 ' O ' ' A' ' 57' ' ' ILE . 66.0 mt -110.34 137.7 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 85' ' ' LEU . 3.6 tt -129.57 119.6 23.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 111.539 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.645 ' N ' HD23 ' A' ' 84' ' ' LEU . 57.3 tp -109.61 119.75 40.36 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.612 ' CD2' HG22 ' A' ' 66' ' ' VAL . 6.3 p90 -136.87 173.08 12.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.438 0.637 . . . . 0.0 112.45 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.456 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -134.9 84.53 2.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.464 179.024 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 80.0 p -72.22 68.22 0.72 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.463 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.432 -1.204 . . . . 0.0 112.447 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 ttp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.828 0.347 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.1 p -121.11 105.01 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -98.5 31.21 2.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.952 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.425 ' NE ' ' HA ' ' A' ' 4' ' ' ARG . 4.9 mmp_? -148.71 -174.03 4.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -155.94 42.47 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.835 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . -160.25 81.13 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.318 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.3 t -134.05 147.01 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.04 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 76' ' ' PHE . 25.7 mt -121.64 112.85 36.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' A' ' 9' ' ' LYS . 3.3 mmmp? -66.53 -43.31 85.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.719 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 49.8 t30 -161.39 138.91 8.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.12 94.99 2.94 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.385 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.488 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 33.5 t70 -80.58 -1.74 43.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.653 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.459 ' HE1' ' HB3' ' A' ' 72' ' ' HIS . 47.8 tpp -86.18 165.13 16.78 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' MET . 80.4 p -36.4 -81.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.757 0.313 . . . . 0.0 111.818 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 176.76 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.207 0.527 . . . . 0.0 110.184 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -56.8 -24.6 51.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.582 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.402 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 2.0 mpt? -80.06 -28.29 39.24 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.448 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.77 ' O ' HG23 ' A' ' 22' ' ' VAL . 34.0 mt-30 -65.18 -47.08 78.25 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -77.25 -35.43 55.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.212 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.446 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.4 t70 -71.07 -53.33 15.05 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.265 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.66 -49.86 67.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.0 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 18' ' ' GLN . 80.1 t -54.65 -49.87 64.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.099 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -71.36 -27.31 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.022 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 95.3 m -71.79 -33.49 68.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.439 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.75 39.13 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.968 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.5 m -79.17 -45.75 19.29 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.904 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -73.69 -25.28 60.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.279 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.633 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -71.96 -53.26 13.58 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 66.2 mtt -73.48 -20.7 60.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.101 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -78.04 -50.67 11.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.879 0.371 . . . . 0.0 110.741 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -81.99 -23.61 35.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.141 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -131.89 165.91 22.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.85 0.357 . . . . 0.0 111.05 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -156.02 35.88 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.998 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 29.7 mt -98.3 -10.58 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.519 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 78.12 -55.1 0.5 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.105 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.42 -53.04 26.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.676 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.81 -25.39 55.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.633 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -65.63 -55.86 17.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.499 179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.32 -23.39 64.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.985 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.424 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -80.24 -39.0 29.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.851 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.27 -27.16 66.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.406 . . . . 0.0 110.088 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.409 HG21 ' SG ' ' A' ' 56' ' ' CYS . 76.2 mt -80.85 -48.67 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.652 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -67.23 -31.77 72.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.086 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.1 mttt -80.48 -29.43 37.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.1 -39.5 78.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.823 0.344 . . . . 0.0 111.167 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.639 ' CD2' HD21 ' A' ' 85' ' ' LEU . 3.8 m-85 -82.05 -36.09 28.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.257 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.07 -17.63 56.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 21.8 ptmt -85.59 3.79 39.12 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.446 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 48' ' ' LYS . 10.4 mtmp? -142.7 -48.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.926 0.393 . . . . 0.0 110.829 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -87.51 6.26 35.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 60.59 156.07 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-O 120.727 0.299 . . . . 0.0 110.721 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 39.8 Cg_exo -56.65 167.03 3.13 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.394 2.063 . . . . 0.0 112.053 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.0 t -139.08 126.98 22.21 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.241 0.616 . . . . 0.0 110.565 0.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.735 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 1.3 m95 -112.19 -171.28 1.82 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.292 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 50.1 m80 -157.39 58.2 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.281 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.855 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.0 t -48.91 133.52 17.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.673 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.795 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 30.9 mm -106.05 142.21 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.687 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.739 ' O ' HG13 ' A' ' 58' ' ' VAL . 10.9 p -129.73 72.16 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.477 -179.546 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.66 -92.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.145 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 11.5 mtp-105 -157.59 67.24 0.5 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.653 0.263 . . . . 0.0 110.894 -179.594 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.504 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER 52.15 12.9 0.24 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.394 179.756 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.795 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.8 p90 -51.67 -25.87 8.05 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.311 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.412 ' N ' ' CD1' ' A' ' 62' ' ' PHE . . . -121.29 48.06 0.98 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.701 179.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.44 ' HA ' HD23 ' A' ' 84' ' ' LEU . 79.9 p -77.6 56.63 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.539 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' A' ' 68' ' ' HIS . 3.1 p90 -98.73 37.7 1.46 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 0.0 110.448 179.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.952 HG22 ' CD2' ' A' ' 86' ' ' PHE . 66.2 t -46.15 -54.26 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.597 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -50.8 -32.54 20.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.052 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.404 ' HB3' ' O ' ' A' ' 65' ' ' TYR . 0.9 OUTLIER -53.65 -24.01 12.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.561 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 88' ' ' SER . 9.5 mp0 -92.78 -77.51 0.44 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.598 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.874 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -176.55 -95.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.845 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.74 ' H ' HG23 ' A' ' 70' ' ' THR . 2.4 mptp? -152.79 22.62 0.59 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.459 ' HB3' ' HE1' ' A' ' 13' ' ' MET . 43.3 m170 -113.12 73.7 0.83 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.987 0.422 . . . . 0.0 110.856 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.528 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 5.8 p90 -113.68 -179.87 3.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.801 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ILE . 7.7 tt 176.39 108.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.998 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 1.1 p90 -113.64 162.57 16.08 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.23 0.538 . . . . 0.0 111.513 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 78' ' ' LEU . 1.3 p90 -153.38 159.05 42.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.111 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.451 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 1.4 t80 -109.78 121.5 45.36 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.96 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.573 HD11 ' HE2' ' A' ' 76' ' ' PHE . 78.7 mt -119.86 112.26 18.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.053 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.41 -90.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.75 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -138.42 31.89 2.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.909 -179.939 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.6 t -146.55 126.14 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.09 134.9 37.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.27 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.778 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.7 mt -115.43 135.8 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.651 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 64' ' ' SER . 52.1 tp -124.36 107.01 10.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.855 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.8 tp -108.64 130.61 55.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.561 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.952 ' CD2' HG22 ' A' ' 66' ' ' VAL . 2.9 p90 -157.54 151.85 24.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.336 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.735 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -127.92 152.87 47.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.244 0.545 . . . . 0.0 111.774 -179.604 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.874 ' HA ' HG22 ' A' ' 70' ' ' THR . 33.1 t -100.57 77.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.288 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.538 ' O ' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.406 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.51 ' HA ' ' CE ' ' A' ' 1' ' ' MET . 10.4 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.862 0.363 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t 60.04 31.67 20.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 62.29 90.26 0.08 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.946 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -124.88 42.68 3.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.672 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 22.1 pttp -113.9 50.01 0.95 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.847 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 67.27 108.86 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.21 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 52.0 p-10 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.482 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 2.5 m-70 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.1 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.813 0.339 . . . . 0.0 111.043 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -155.29 96.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.1 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' HG2' ' A' ' 18' ' ' GLN . 69.0 mt -79.21 112.43 17.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.948 0.404 . . . . 0.0 110.994 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -80.97 -32.36 34.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.933 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -168.45 114.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.619 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -112.49 117.96 33.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.452 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.87 -13.68 18.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.844 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 41.9 tpp -75.32 170.91 15.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.377 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.0 t -73.38 38.01 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.552 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 92.0 mt-10 68.65 -43.91 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -45.39 -40.22 7.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.619 0.247 . . . . 0.0 111.64 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.527 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -71.91 -26.42 62.3 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.16 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.673 ' HG2' HD13 ' A' ' 8' ' ' ILE . 60.9 mt-30 -64.79 -42.62 94.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -77.09 -40.13 47.14 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.183 178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -70.98 -57.67 4.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.379 . . . . 0.0 110.907 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.688 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -55.21 -49.83 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.534 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 18' ' ' GLN . 61.3 t -57.66 -44.82 86.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.352 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -73.96 -30.63 62.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 85.7 m -71.97 -32.99 67.8 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -80.93 -24.91 37.85 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.252 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.406 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 93.4 m -81.25 -43.83 18.63 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.995 0.426 . . . . 0.0 109.925 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.416 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 41.5 tt0 -74.87 -26.27 59.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.384 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -78.56 -39.39 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.094 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.406 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.4 ptt? -77.21 -26.86 53.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.49 ' OE2' ' HB2' ' A' ' 31' ' ' LYS . 0.8 OUTLIER -87.01 -37.66 17.3 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HB2' ' OE2' ' A' ' 30' ' ' GLU . 24.3 ttmm -79.21 -28.31 42.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.203 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -146.73 176.28 9.98 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.803 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -158.04 27.49 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.173 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 35.6 mm -75.35 -13.03 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.549 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 42.9 mt-10 76.56 -54.46 0.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.036 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -74.81 -50.15 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.94 0.4 . . . . 0.0 110.572 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -56.26 -29.6 61.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.15 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.401 HG23 ' CB ' ' A' ' 28' ' ' ALA . 44.3 mm -62.3 -56.06 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.634 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.75 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.25 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.465 ' O ' ' CB ' ' A' ' 44' ' ' LYS . . . -78.66 -41.49 31.15 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.78 -26.36 65.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.1 mt -80.32 -48.27 20.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.942 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 2.7 pptp? -69.69 -32.67 71.42 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.764 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 51.9 tttp -68.24 -44.98 74.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.939 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.73 -43.4 98.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.1 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.16 -16.71 52.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.615 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -87.0 -43.02 12.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.795 0.331 . . . . 0.0 111.115 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -90.26 21.77 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.649 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -138.0 -42.87 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.659 0.266 . . . . 0.0 111.226 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -111.29 10.6 21.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.664 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 62.5 142.72 0.06 OUTLIER Pre-proline 0 CA--C 1.529 0.165 0 CA-C-O 120.638 0.256 . . . . 0.0 110.898 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -50.0 173.91 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.339 2.026 . . . . 0.0 112.358 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -125.15 112.28 16.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.015 0.526 . . . . 0.0 110.611 -0.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.549 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 7.1 m95 -102.32 -167.29 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.802 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -176.14 90.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.767 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -89.19 144.32 26.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.491 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.608 ' O ' HG23 ' A' ' 83' ' ' ILE . 9.2 mm -115.15 150.94 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.66 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.515 ' HA ' HG12 ' A' ' 83' ' ' ILE . 47.7 t -137.42 91.66 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.267 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.77 -83.55 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.218 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.53 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 64.0 mtm-85 -140.97 -75.86 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.38 . . . . 0.0 111.137 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.545 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -161.07 23.1 0.13 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.895 -179.645 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.7 p90 -71.91 2.47 5.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -177.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.81 -58.6 13.72 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m 44.69 54.01 6.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.477 ' CG ' ' O ' ' A' ' 65' ' ' TYR . 37.8 t80 -165.77 31.6 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.745 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.662 HG13 ' HB3' ' A' ' 73' ' ' PHE . 59.7 t -84.6 -72.77 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.396 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.6 m -69.64 -26.07 64.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.996 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -46.62 -25.29 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.847 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.526 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 17.1 pt-20 -103.88 -63.6 1.18 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.709 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.817 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.6 t -150.94 -116.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HD2' ' C ' ' A' ' 70' ' ' THR . 7.5 mptt -154.29 30.61 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.685 0.278 . . . . 0.0 110.954 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.409 ' HD2' HG21 ' A' ' 70' ' ' THR . 90.3 m-70 -105.94 68.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.871 0.367 . . . . 0.0 110.894 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.662 ' HB3' HG13 ' A' ' 66' ' ' VAL . 5.6 p90 -117.74 175.5 5.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.176 0.512 . . . . 0.0 111.434 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 74' ' ' ILE . 9.4 tt -160.4 110.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.359 178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.46 ' CE2' ' CE1' ' A' ' 73' ' ' PHE . 66.4 m-85 -91.4 140.04 30.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.921 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.688 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 24.8 p90 -161.14 121.0 2.65 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 110.079 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.463 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 31.6 t80 -92.6 139.22 30.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.949 -177.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -111.5 162.98 14.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.89 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -51.79 100.14 0.05 OUTLIER Glycine 0 CA--C 1.521 0.418 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.423 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.46 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 71.85 25.09 3.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.149 0.499 . . . . 0.0 110.685 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.484 HG12 ' N ' ' A' ' 82' ' ' ALA . 95.9 t -155.54 158.82 3.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.924 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -132.42 143.12 49.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.704 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.641 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 54.0 mt -140.16 137.78 37.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.724 0.297 . . . . 0.0 110.68 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.667 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -138.12 115.67 11.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 56' ' ' CYS . 56.1 tp -102.18 130.73 48.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.629 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.475 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.3 p90 -151.67 157.71 42.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.549 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -146.62 162.67 37.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.942 -179.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.817 ' HA ' HG22 ' A' ' 70' ' ' THR . 93.4 p -94.07 167.8 11.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.054 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.528 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.157 0 CA-C-O 120.639 0.257 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 57.8 t -148.79 107.98 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.088 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.759 HD13 ' OE1' ' A' ' 18' ' ' GLN . 68.4 mt -86.05 115.85 28.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.899 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -84.84 -31.08 24.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.621 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -171.9 112.08 0.3 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.723 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -132.06 105.94 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.036 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.426 ' OD1' ' CD1' ' A' ' 73' ' ' PHE . 12.6 p-10 -77.63 -4.41 45.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.245 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.503 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.3 tpp -75.02 165.77 24.73 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' CG ' ' A' ' 15' ' ' GLU . 79.8 p -50.54 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.669 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 47.4 mt-10 -162.99 -36.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.55 0.691 . . . . 0.0 110.194 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.53 -27.64 57.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.503 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.9 mpt? -77.67 -25.35 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.441 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.759 ' OE1' HD13 ' A' ' 8' ' ' ILE . 41.2 mm-40 -65.51 -50.12 66.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -77.48 -32.47 54.36 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.688 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.1 t0 -73.64 -50.4 21.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.858 0.361 . . . . 0.0 110.602 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -59.82 -47.77 84.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.315 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -58.76 -51.61 69.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.066 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.21 -28.39 65.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.556 0.217 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 24.7 t -71.48 -32.34 68.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.01 -25.55 37.12 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.115 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.1 m -79.55 -45.11 19.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.119 0.485 . . . . 0.0 109.811 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.51 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.5 mt-30 -73.12 -26.34 61.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.324 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.67 -39.96 50.49 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.075 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -73.1 -32.33 64.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.51 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 12.4 pt-20 -80.58 -45.28 17.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.104 0.478 . . . . 0.0 109.758 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.402 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 57.0 tptt -71.52 -20.82 61.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.673 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -142.49 133.14 25.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.903 0.382 . . . . 0.0 111.088 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -102.72 29.94 5.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.492 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.512 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.8 mt -115.11 168.79 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.512 ' H ' HG22 ' A' ' 34' ' ' ILE . 16.7 pt-20 -113.24 18.87 17.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.524 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -125.97 -44.39 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.732 0.301 . . . . 0.0 110.223 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -68.2 -17.09 64.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.444 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 40.1 mm -69.63 -51.76 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.399 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.78 -22.16 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.108 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.66 -38.89 25.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' A' ' 45' ' ' GLU . 6.5 t80 -70.54 -26.31 63.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.19 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.418 HG21 ' CB ' ' A' ' 56' ' ' CYS . 78.6 mt -84.01 -43.85 17.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 62.8 tttp -67.26 -35.6 79.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.64 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 26.6 tptp -68.86 -59.89 2.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.387 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' A' ' 41' ' ' TYR . 5.4 mm-40 -49.57 -51.72 35.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.89 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.66 ' CD2' HD21 ' A' ' 85' ' ' LEU . 14.6 m-85 -67.75 -31.23 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.395 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 6.3 t70 -73.58 -26.27 60.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -90.05 -24.77 21.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.98 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -95.76 -57.91 2.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.202 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -94.69 17.05 14.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 58.98 161.17 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.33 170.2 15.29 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.602 2.201 . . . . 0.0 111.922 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.0 m -124.5 104.73 8.89 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.282 0.633 . . . . 0.0 110.572 -0.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.453 ' HZ3' ' HE3' ' A' ' 13' ' ' MET . 7.3 m95 -99.9 -171.11 1.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.59 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 77.9 t60 -179.98 85.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.955 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.832 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -66.65 153.28 43.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.861 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.899 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.6 mm -118.16 138.73 47.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.282 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.615 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.6 p -119.48 62.39 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.46 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.68 -92.73 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.597 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.826 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 79.0 mtt-85 -144.94 -65.25 0.34 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.0 111.349 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.521 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.87 19.3 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.843 -179.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.673 ' CE1' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -67.49 5.16 0.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.14 57.82 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.878 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.9 m -69.08 55.47 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.027 0.441 . . . . 0.0 111.662 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 4.7 m-85 -99.22 35.11 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.55 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 66' ' ' VAL . 44.2 t -98.48 -1.34 10.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.791 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.9 m -115.55 -27.7 7.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 0.0 111.043 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.554 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 36.1 m80 -50.12 -26.43 4.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.242 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 22.6 pt-20 156.66 45.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 120.889 0.376 . . . . 0.0 110.975 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 20.0 m -94.04 -84.05 0.32 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.481 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 74.84 -12.41 0.94 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.536 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.443 ' H ' HG22 ' A' ' 70' ' ' THR . 9.0 t-160 -139.02 82.87 1.92 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.527 ' HD1' ' N ' ' A' ' 74' ' ' ILE . 7.7 p90 -110.51 -172.3 2.0 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.085 0.469 . . . . 0.0 111.753 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.723 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.5 tt -160.93 113.16 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.749 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 8.1 m-30 -100.94 153.72 19.28 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.484 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 20.6 p90 -170.27 137.49 1.5 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.721 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.458 ' O ' HD23 ' A' ' 78' ' ' LEU . 1.3 t80 -93.67 134.24 36.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.158 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.897 HD12 HD12 ' A' ' 83' ' ' ILE . 81.4 mt -131.72 125.44 32.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.84 -110.94 1.42 Allowed Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.086 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.579 ' HA ' ' NE2' ' A' ' 80' ' ' GLN . 5.0 mm100 -128.61 49.65 2.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.346 0.593 . . . . 0.0 110.603 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.433 HG23 ' C ' ' A' ' 80' ' ' GLN . 91.7 t -160.2 138.61 2.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.638 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.826 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -83.91 134.06 34.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.272 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.899 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.3 mt -135.69 133.41 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.724 HD13 ' N ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -148.87 143.89 26.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.743 -0.783 . . . . 0.0 112.474 -179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' ' 56' ' ' CYS . 61.1 tp -116.81 155.99 28.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.271 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.464 ' H ' HD12 ' A' ' 85' ' ' LEU . 10.9 p90 -164.3 158.68 19.04 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 0.0 111.977 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.44 ' HB2' ' CH2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -108.25 76.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.737 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 81.2 p -74.91 73.97 2.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.407 -1.219 . . . . 0.0 112.56 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.552 ' N ' HD22 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.65 0.262 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.443 HG12 ' N ' ' A' ' 8' ' ' ILE . 45.1 t -147.9 155.17 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.992 0.425 . . . . 0.0 111.635 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.817 HD11 ' HB3' ' A' ' 18' ' ' GLN . 77.6 mt -130.11 123.19 55.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.668 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -87.14 -31.93 20.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.442 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -178.99 110.92 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.607 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.776 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -156.1 144.95 20.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.191 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.486 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.3 t70 -143.47 18.22 1.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.61 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.499 ' CG ' ' HG3' ' A' ' 17' ' ' MET . 50.3 tpp -69.5 65.65 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.69 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 47.1 t 56.97 12.7 1.27 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 47.6 mt-10 69.35 -49.77 0.61 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -46.31 -36.16 6.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.646 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.624 ' HB2' HD12 ' A' ' 74' ' ' ILE . 21.8 mmt -75.84 -24.41 55.81 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.769 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.817 ' HB3' HD11 ' A' ' 8' ' ' ILE . 64.9 mt-30 -67.02 -41.7 86.16 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -82.53 -34.54 27.86 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.021 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' OD1' ' A' ' 23' ' ' ASP . 7.8 t0 -74.81 -37.76 62.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.154 0.502 . . . . 0.0 110.527 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.465 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -71.01 -45.66 63.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.708 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 18' ' ' GLN . 73.9 t -59.43 -55.11 25.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.266 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 20' ' ' ASP . 57.7 p30 -67.25 -25.23 65.98 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.057 -0.257 . . . . 0.0 110.987 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 54.1 t -72.46 -36.53 68.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -75.12 -26.33 59.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.645 178.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -76.65 -53.97 7.3 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.745 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.419 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -63.4 -24.57 67.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.451 178.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.02 58.42 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.64 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.6 ptp -75.75 -24.6 56.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.131 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -79.35 -51.01 9.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.0 110.075 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -72.16 -27.12 62.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.575 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -135.3 146.79 48.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.753 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -134.44 42.57 2.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.027 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.5 mt -101.43 -13.31 8.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.555 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.9 mt-10 76.85 -54.51 0.57 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.212 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -71.98 -56.03 6.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.485 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.465 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.07 -25.49 31.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.249 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.61 -49.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.38 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.736 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -65.15 -22.58 66.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.161 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.55 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.74 -40.42 22.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.403 ' O ' ' CD1' ' A' ' 41' ' ' TYR . 5.4 t80 -68.36 -28.35 67.05 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.33 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 25' ' ' ALA . 96.5 mt -77.36 -49.92 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.985 179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.6 ptmt -65.34 -36.26 83.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.55 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.7 tptm -55.24 -55.55 30.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.65 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.06 -54.97 38.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.839 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.444 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.8 m-85 -63.54 -20.05 65.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.263 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -74.44 -56.31 4.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.656 0.265 . . . . 0.0 111.255 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HE2' ' CE ' ' A' ' 44' ' ' LYS . 68.1 mttm -87.0 7.81 26.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.757 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -114.37 -29.89 6.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 111.025 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CZ ' ' CE ' ' A' ' 17' ' ' MET . 48.6 m-85 -130.37 6.55 4.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.42 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.53 150.63 0.1 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-O 120.636 0.255 . . . . 0.0 111.049 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -56.92 172.55 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.526 2.151 . . . . 0.0 112.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -121.97 126.4 48.49 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.105 0.562 . . . . 0.0 110.709 -0.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.482 ' CZ2' ' HG2' ' A' ' 87' ' ' LYS . 3.6 m95 -122.29 172.17 8.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.758 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.412 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 37.9 m80 -149.74 81.62 1.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.327 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.662 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.2 p -72.9 138.38 46.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.799 ' O ' HG23 ' A' ' 83' ' ' ILE . 29.2 mm -109.04 147.15 13.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.379 179.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.736 HG21 ' HB2' ' A' ' 39' ' ' ALA . 52.9 t -129.44 74.27 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.713 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 178.94 -100.16 0.14 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.383 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -126.68 -77.1 0.58 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 120.881 0.372 . . . . 0.0 110.882 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.529 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.53 19.44 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.091 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.656 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 8.1 p90 -58.62 -15.53 12.0 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.62 54.26 0.76 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.46 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.446 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 41.0 t -60.88 -95.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.412 ' OH ' ' HB3' ' A' ' 55' ' ' HIS . 36.9 p90 41.71 37.87 0.83 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.476 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.977 HG22 ' CE1' ' A' ' 86' ' ' PHE . 47.6 t -60.07 -39.04 79.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.1 m -68.94 -29.13 67.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -49.79 -26.09 3.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 110.27 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 8.8 mp0 -82.01 -77.25 0.23 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.416 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.2 t -172.42 -86.63 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.272 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.825 ' H ' HG23 ' A' ' 70' ' ' THR . 1.5 tptm -166.95 29.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.214 0.53 . . . . 0.0 109.841 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.422 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 93.4 m-70 -129.29 81.27 2.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.618 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 5.9 p90 -112.7 179.06 4.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.929 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.776 HG13 ' HB1' ' A' ' 11' ' ' ALA . 8.0 tt -162.29 111.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.457 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.904 ' OH ' HG21 ' A' ' 66' ' ' VAL . 7.0 m-30 -100.61 151.03 22.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.465 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 1.7 p90 -168.18 116.4 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.967 0.413 . . . . 0.0 110.802 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.657 ' O ' HD23 ' A' ' 78' ' ' LEU . 4.3 t80 -84.7 141.14 30.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.89 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 77' ' ' TYR . 80.0 mt -139.05 135.8 34.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.18 -93.15 0.01 OUTLIER Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.761 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.907 ' OE1' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -139.93 20.9 2.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.688 0.28 . . . . 0.0 111.608 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.907 HG23 ' OE1' ' A' ' 80' ' ' GLN . 92.3 t -140.26 129.95 28.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.87 0.367 . . . . 0.0 110.862 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -89.08 128.53 35.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.818 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.799 HG23 ' O ' ' A' ' 57' ' ' ILE . 59.7 mt -104.11 135.87 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.844 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.578 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 10.2 mp -122.42 107.45 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.609 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 56' ' ' CYS . 65.4 tp -110.01 120.35 42.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.872 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.977 ' CE1' HG22 ' A' ' 66' ' ' VAL . 1.5 m-85 -111.1 165.14 12.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.868 0.366 . . . . 0.0 111.055 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HG2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -136.44 117.72 14.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.659 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 70' ' ' THR . 46.1 t -98.41 151.81 20.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.913 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.537 179.923 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 N--CA 1.458 -0.043 0 CA-C-O 120.845 0.355 . . . . 0.0 111.023 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.508 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 55.4 t -143.83 138.83 25.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.096 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.878 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.1 mp -103.97 136.44 37.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.206 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 61.7 mttp -94.28 29.0 2.32 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.577 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.715 ' H ' HG22 ' A' ' 8' ' ' ILE . 45.1 t30 87.68 106.68 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.328 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.467 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -126.88 179.05 5.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.05 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -168.6 19.22 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.541 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 44.8 ttp -80.35 62.88 4.63 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.206 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 45.6 m 72.55 1.57 4.03 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.442 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 46.7 mt-10 70.5 -51.18 0.66 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.783 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -48.26 -29.25 3.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.945 0.402 . . . . 0.0 110.326 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.485 ' HG2' ' HE3' ' A' ' 13' ' ' MET . 1.0 OUTLIER -72.72 -29.86 63.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.464 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.872 ' HA ' HD11 ' A' ' 74' ' ' ILE . 65.6 mt-30 -65.29 -38.33 89.89 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -73.63 -44.43 57.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.39 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.71 -54.33 9.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.258 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.516 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -55.35 -52.1 64.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.425 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 18' ' ' GLN . 78.1 t -57.6 -50.56 76.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.036 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.3 m-20 -69.79 -24.75 63.54 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.787 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -71.75 -38.05 70.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.62 -23.02 53.38 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.779 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.402 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 89.3 m -78.92 -50.88 10.47 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.526 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 23.9 pt20 -69.74 -23.92 63.46 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.373 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.431 ' C ' HD12 ' A' ' 38' ' ' ILE . . . -76.88 -43.49 35.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.062 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.402 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.1 ptt? -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.739 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.3 pt-20 -84.25 -43.95 14.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.049 0.452 . . . . 0.0 109.932 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.405 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 99.1 mttt -74.2 -21.02 59.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.503 ' HB2' HD11 ' A' ' 38' ' ' ILE . 2.3 m-85 -131.28 -172.24 2.79 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.701 0.286 . . . . 0.0 110.808 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -173.97 35.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.807 0.337 . . . . 0.0 111.122 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.692 HD12 ' OD2' ' A' ' 37' ' ' ASP . 31.2 mt -99.41 -18.07 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 67.45 11.86 8.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.305 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -129.07 -54.44 1.2 Allowed 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' HD12 ' A' ' 34' ' ' ILE . 26.7 m-20 -58.7 -23.03 58.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 32' ' ' TYR . 44.3 mm -61.37 -58.55 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.359 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.654 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -62.55 -21.21 65.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.937 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -81.81 -41.57 20.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.985 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -70.15 -22.82 62.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.809 0.338 . . . . 0.0 110.582 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.9 mt -82.31 -48.45 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 23.5 pttm -70.47 -33.75 71.62 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.842 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 59.1 mtpt -72.49 -38.42 68.16 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -61.71 -40.81 96.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 110.431 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.5 m-85 -81.51 -36.73 28.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.396 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -75.03 -26.62 59.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.664 0.269 . . . . 0.0 111.369 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -90.24 29.52 1.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.813 0.339 . . . . 0.0 111.212 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -155.0 -44.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.678 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -106.94 -4.89 18.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.461 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.449 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 74.0 m-80 63.53 162.33 0.12 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-O 120.647 0.261 . . . . 0.0 111.122 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HB3' HG22 ' A' ' 53' ' ' THR . 79.6 Cg_exo -46.32 173.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.826 2.351 . . . . 0.0 112.38 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.541 HG22 ' HB3' ' A' ' 52' ' ' PRO . 66.7 p -119.24 115.08 23.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.232 0.613 . . . . 0.0 110.629 -0.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.66 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 1.1 m95 -114.62 -174.13 2.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.136 0.493 . . . . 0.0 110.932 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 58.5 m-70 -163.45 61.8 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.202 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -53.52 137.88 35.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.402 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.814 ' O ' HG23 ' A' ' 83' ' ' ILE . 28.8 mm -115.59 149.84 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.343 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.654 HG21 ' HB2' ' A' ' 39' ' ' ALA . 47.7 t -141.34 53.83 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.132 0.491 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -155.06 -67.3 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.72 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.961 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -177.23 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.681 0.276 . . . . 0.0 111.351 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.516 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -172.5 18.54 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.669 ' CE1' HG23 ' A' ' 57' ' ' ILE . 39.4 p90 -59.89 -33.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.431 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.76 -58.21 5.45 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.337 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.422 ' O ' ' CD1' ' A' ' 65' ' ' TYR . 81.2 p 51.41 75.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD1' ' O ' ' A' ' 64' ' ' SER . 23.1 m-85 -143.1 29.72 1.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.214 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.623 HG21 ' OH ' ' A' ' 75' ' ' TYR . 47.7 t -58.73 -62.08 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.701 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.405 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 86.6 m -55.52 -31.7 62.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.83 0.347 . . . . 0.0 110.949 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.458 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 18.7 t-160 -77.13 -5.52 49.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.066 178.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 89.3 mt-10 -160.47 50.58 0.28 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 66' ' ' VAL . 98.9 m -86.48 -9.05 57.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.579 ' HA ' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -45.28 -24.66 0.3 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.718 0.294 . . . . 0.0 111.744 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 71' ' ' LYS . 4.3 m170 -171.91 99.92 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.109 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.541 ' O ' ' HB2' ' A' ' 13' ' ' MET . 2.1 p90 -113.97 166.55 11.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.502 . . . . 0.0 111.761 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.872 HD11 ' HA ' ' A' ' 18' ' ' GLN . 8.2 tt -158.79 123.71 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.001 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.878 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 m-30 -111.18 139.31 46.67 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.516 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.8 p90 -170.47 132.37 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.025 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.606 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 2.5 p90 -126.43 154.31 43.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.737 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 6' ' ' ALA . 81.5 mt -115.58 103.13 10.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.519 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.26 -86.67 0.4 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.485 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.479 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -124.63 -11.79 7.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.7 t -95.59 120.15 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.718 0.294 . . . . 0.0 110.778 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.961 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -98.48 129.0 45.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 111.758 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 57' ' ' ILE . 69.3 mt -109.34 131.39 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.014 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 83' ' ' ILE . 6.4 mp -127.88 107.79 10.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.646 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 46' ' ' PHE . 67.0 tp -106.91 133.81 51.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.405 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.516 ' HB3' ' HA ' ' A' ' 73' ' ' PHE . 10.6 p90 -169.72 157.09 6.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.087 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.66 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -144.99 157.67 44.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.281 0.563 . . . . 0.0 111.795 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.514 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 41.9 t -87.61 179.49 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.2 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.332 -1.26 . . . . 0.0 112.451 179.692 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.715 0.293 . . . . 0.0 111.027 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.488 ' HB ' ' CZ ' ' A' ' 77' ' ' TYR . 43.7 t -131.72 149.18 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.134 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.831 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.8 mp -108.0 138.05 36.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.106 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 27.5 mtpp -96.92 29.4 3.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.11 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.649 ' H ' HG22 ' A' ' 8' ' ' ILE . 0.7 OUTLIER 88.97 85.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.576 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.555 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -98.81 165.75 11.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.184 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.1 t70 -148.93 21.57 0.99 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.555 ' O ' ' HG2' ' A' ' 13' ' ' MET . 47.3 ttm -94.54 42.27 1.09 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 16' ' ' ASP . 50.0 m 68.19 111.94 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.853 0.359 . . . . 0.0 110.321 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.438 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 8.6 mp0 -33.69 -34.62 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.194 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 14' ' ' SER . 7.5 t70 -55.82 -45.22 78.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.863 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.552 ' HE1' ' CZ ' ' A' ' 50' ' ' TYR . 23.4 mmt -69.96 -22.14 63.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.757 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.826 ' HA ' HD11 ' A' ' 74' ' ' ILE . 0.7 OUTLIER -68.78 -39.57 80.14 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.62 -38.61 54.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.823 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -72.8 -54.41 8.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.433 . . . . 0.0 110.535 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.23 -49.86 70.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.284 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 18' ' ' GLN . 77.8 t -57.86 -54.66 28.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.199 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.549 ' O ' HG22 ' A' ' 26' ' ' THR . 63.2 m-20 -66.78 -26.13 66.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.805 0.336 . . . . 0.0 110.746 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 49.3 t -73.05 -29.09 62.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 78' ' ' LEU . . . -77.67 -31.83 52.79 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.346 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 23' ' ' ASP . 3.9 t -78.48 -48.73 14.75 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.155 -0.684 . . . . 0.0 109.155 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' N ' ' CG2' ' A' ' 26' ' ' THR . 11.6 mm100 -64.42 -25.6 68.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.125 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -74.96 -44.63 47.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.977 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.599 ' HE3' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -75.91 -24.07 55.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.22 -179.786 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.599 ' HG3' ' HE3' ' A' ' 29' ' ' MET . 96.5 mt-10 -77.51 -55.84 5.04 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.984 0.421 . . . . 0.0 110.021 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.81 -25.17 67.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.762 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -141.18 135.05 30.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -102.28 26.1 8.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.319 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 35' ' ' GLU . 5.6 mm -98.55 177.14 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 34' ' ' ILE . 56.2 mt-10 -115.22 0.22 13.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.662 0.268 . . . . 0.0 110.935 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 8.0 mtpm? -111.27 -47.69 3.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.272 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -59.71 -26.21 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 39.8 mm -63.85 -58.97 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.341 179.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -19.84 64.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.0 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -78.9 -43.12 25.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.98 -28.26 66.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.003 0.43 . . . . 0.0 110.015 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.4 mt -82.59 -46.59 19.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.485 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -67.88 -30.77 70.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.169 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 45.3 mmtm -79.03 -40.26 31.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.78 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.5 -42.38 87.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.031 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -82.0 -45.43 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.763 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -25.67 65.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.469 ' NZ ' ' HB2' ' A' ' 48' ' ' LYS . 4.7 ttmp? -71.06 -21.27 62.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.615 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -125.13 -4.44 7.42 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.552 ' CZ ' ' HE1' ' A' ' 17' ' ' MET . 2.8 m-85 -130.19 4.98 4.84 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.89 156.78 0.1 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 111.146 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.431 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.7 Cg_endo -60.49 174.66 1.46 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.545 2.163 . . . . 0.0 112.089 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.431 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 9.0 t -122.26 125.21 45.54 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.132 0.573 . . . . 0.0 110.884 0.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.0 m95 -117.27 -171.61 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.509 ' CD2' HD11 ' A' ' 57' ' ' ILE . 73.4 t60 -174.31 72.64 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.998 0.427 . . . . 0.0 110.878 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.844 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -59.43 128.85 39.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.836 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.823 ' O ' HG23 ' A' ' 83' ' ' ILE . 33.3 mm -98.5 147.22 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 58' ' ' VAL . 49.1 t -127.98 65.16 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.821 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.794 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.11 -97.15 0.11 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -123.6 -83.75 0.65 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.656 0.265 . . . . 0.0 110.922 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.476 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -152.34 10.96 0.52 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.818 -179.727 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.605 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 23.2 p90 -49.24 -24.1 1.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -177.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.85 44.64 1.33 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.456 -0.878 . . . . 0.0 113.068 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.6 m -93.59 62.13 3.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -109.75 29.79 7.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.164 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.549 HG11 ' N ' ' A' ' 87' ' ' LYS . 47.6 t -118.37 -22.59 4.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.549 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.9 m -48.45 -27.69 2.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -45.7 -28.25 0.98 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.5 mm-40 -108.55 -67.51 0.97 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.219 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.466 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 11.4 m 80.47 0.6 1.92 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.901 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HG3' ' CE1' ' A' ' 72' ' ' HIS . 21.9 tptm -47.1 -28.52 1.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.196 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.506 ' CE1' ' HG3' ' A' ' 71' ' ' LYS . 67.0 m80 -157.05 93.94 1.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.395 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.568 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -120.98 152.28 38.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.235 -179.383 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.826 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -152.42 120.5 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.217 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.831 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.6 m-85 -107.68 139.26 42.5 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.921 0.391 . . . . 0.0 111.376 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 1.5 p90 -170.28 122.22 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.489 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.567 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 4.8 p90 -104.99 144.7 31.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.062 0.458 . . . . 0.0 111.526 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.417 HD11 ' CB ' ' A' ' 25' ' ' ALA . 71.3 mt -111.98 110.98 21.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.422 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -76.58 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.422 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.435 HE21 HG23 ' A' ' 81' ' ' VAL . 3.1 pm0 -149.02 25.7 0.91 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 0.0 111.035 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.794 HG13 ' HA2' ' A' ' 59' ' ' GLY . 53.3 t -133.26 100.87 3.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.031 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.567 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -69.76 127.27 32.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.607 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.823 HG23 ' O ' ' A' ' 57' ' ' ILE . 62.5 mt -104.04 138.53 28.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.553 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.598 HD12 ' O ' ' A' ' 83' ' ' ILE . 11.0 mp -128.09 103.66 7.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.019 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.844 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.1 tp -108.31 113.31 26.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.517 ' CB ' HG11 ' A' ' 66' ' ' VAL . 9.0 m-85 -127.14 -179.19 4.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 111.565 -178.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.549 ' N ' HG11 ' A' ' 66' ' ' VAL . 1.5 tmtp? -151.87 98.47 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.069 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.494 ' N ' HG13 ' A' ' 66' ' ' VAL . 48.0 t -73.17 81.05 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.829 0.347 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.463 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.764 0.316 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 8' ' ' ILE . 26.6 t -153.76 163.91 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.243 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.623 HD13 ' HG3' ' A' ' 18' ' ' GLN . 58.8 mt -114.69 115.31 49.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.343 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -70.07 -41.26 74.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.272 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.66 74.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 0.0 110.679 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -79.18 142.63 36.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.482 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 8.8 t70 -146.78 23.55 1.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.68 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.498 ' HE2' ' O ' ' A' ' 72' ' ' HIS . 27.4 ttm -107.9 47.58 0.89 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.076 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.479 ' HB3' ' O ' ' A' ' 13' ' ' MET . 33.2 t 74.37 114.82 0.06 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.617 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 16.6 pt-20 -32.56 -35.67 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.666 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 14' ' ' SER . 65.9 t0 -54.55 -37.57 65.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.858 0.361 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.443 ' HB3' HD12 ' A' ' 74' ' ' ILE . 1.0 OUTLIER -74.71 -19.82 60.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.923 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -70.76 -45.06 65.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -78.75 -32.95 46.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.582 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.436 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.9 t70 -72.09 -46.62 56.05 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.431 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -61.08 -41.61 96.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.636 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 18' ' ' GLN . 76.6 t -57.69 -58.46 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-O 120.716 0.293 . . . . 0.0 110.587 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 55.9 m-20 -66.13 -30.39 70.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.187 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.686 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -68.67 -33.9 74.78 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.92 -25.38 37.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.678 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.6 m -74.86 -49.86 19.02 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.782 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 23' ' ' ASP . 9.1 mp0 -73.53 -24.38 60.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.613 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -68.84 -45.73 70.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.905 0.383 . . . . 0.0 110.255 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.558 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.0 mmt -79.53 -19.7 48.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.784 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -79.3 -46.45 17.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.542 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -81.07 -18.28 47.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.316 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -149.84 167.09 27.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.811 0.339 . . . . 0.0 111.35 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -156.54 45.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.993 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.524 HG21 ' OD1' ' A' ' 37' ' ' ASP . 30.2 mt -99.65 -7.06 9.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.391 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.9 mt-10 76.44 -56.07 0.57 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.954 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.488 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 7.9 mtpm? -76.76 -53.66 7.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.578 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.524 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.6 -26.81 45.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.223 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.613 HG23 ' HB1' ' A' ' 28' ' ' ALA . 48.3 mm -61.27 -52.32 62.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.279 179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.11 -26.59 62.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.047 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -77.45 -42.91 34.24 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.96 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.429 ' CE1' ' OE2' ' A' ' 45' ' ' GLU . 5.1 t80 -68.88 -31.14 69.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.069 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.686 HG23 ' SG ' ' A' ' 24' ' ' CYS . 97.2 mt -76.62 -50.65 21.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.744 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 17.9 ptpt -63.63 -35.19 79.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.514 ' C ' ' HD3' ' A' ' 44' ' ' LYS . 0.9 OUTLIER -56.41 -52.57 64.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.623 179.271 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.429 ' OE2' ' CE1' ' A' ' 41' ' ' TYR . 94.3 mt-10 -58.15 -48.68 79.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.675 0.274 . . . . 0.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.559 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -64.97 -21.13 66.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.617 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 41.8 m-20 -80.33 -34.36 36.75 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.687 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 7.7 mmpt? -90.13 13.95 13.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.541 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 6.7 ttpm? -119.43 -6.75 10.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.484 0.183 . . . . 0.0 111.329 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.452 ' CE2' ' HE2' ' A' ' 49' ' ' LYS . 51.2 m-85 -148.61 -79.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 111.07 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -177.98 135.77 0.35 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.716 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.31 169.27 22.02 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.425 2.083 . . . . 0.0 112.445 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.9 m -114.32 127.85 56.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.982 0.513 . . . . 0.0 110.844 0.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.455 ' CD1' ' OD1' ' A' ' 47' ' ' ASP . 7.9 m95 -89.02 176.06 7.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.053 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.435 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 73.8 t60 -155.4 103.97 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.952 0.406 . . . . 0.0 110.841 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.774 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.1 t -93.83 147.37 23.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.066 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.501 HG23 ' CE1' ' A' ' 62' ' ' PHE . 6.9 mm -117.46 162.41 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.66 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.408 ' N ' HG22 ' A' ' 57' ' ' ILE . 59.1 t -147.19 87.51 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.052 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.66 -87.5 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.488 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 77.9 mtt-85 -157.99 66.54 0.47 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.946 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.465 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER 49.46 15.67 0.14 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.252 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.501 ' CE1' HG23 ' A' ' 57' ' ' ILE . 6.3 p90 -59.68 -19.03 46.9 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.521 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -54.4 -51.26 52.67 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.903 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.1 m 49.34 70.18 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.877 0.37 . . . . 0.0 110.583 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.488 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 1.6 t80 -149.65 50.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.149 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.541 ' O ' HG12 ' A' ' 66' ' ' VAL . 39.4 t -119.67 -0.88 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.069 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -107.21 -29.05 9.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.715 0.293 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.516 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 93.2 m-70 -49.09 -27.47 3.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.816 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 14.4 pt-20 153.52 49.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.59 0.556 . . . . 0.0 110.9 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 44.8 m -103.1 -86.79 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.317 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 75.35 -13.86 0.82 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.65 -179.501 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.498 ' O ' ' HE2' ' A' ' 13' ' ' MET . 53.3 m170 -123.29 81.17 1.86 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 5.7 p90 -114.29 170.95 7.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.716 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.526 HG13 ' HB1' ' A' ' 11' ' ' ALA . 7.5 tt -147.18 108.42 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.579 178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.6 ' CD1' HD13 ' A' ' 84' ' ' LEU . 7.6 m-30 -76.64 149.87 36.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.487 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HB3' ' HB ' ' A' ' 83' ' ' ILE . 3.2 t80 -150.53 135.42 17.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.217 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 51.9 t80 -125.89 127.76 46.52 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.757 0.313 . . . . 0.0 111.459 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.651 HD12 ' N ' ' A' ' 78' ' ' LEU . 0.7 OUTLIER -126.57 109.79 12.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.795 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.41 -88.1 0.01 OUTLIER Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.768 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.508 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -129.61 21.42 5.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 111.021 -179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.52 HG12 ' N ' ' A' ' 82' ' ' ALA . 53.8 t -128.16 160.76 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.737 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.52 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -130.11 115.04 16.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.785 0.326 . . . . 0.0 111.303 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.581 ' HB ' ' HB3' ' A' ' 76' ' ' PHE . 68.5 mt -95.16 125.01 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.6 HD13 ' CD1' ' A' ' 75' ' ' TYR . 52.0 tp -119.87 107.28 12.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.704 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.774 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.6 tp -106.87 150.44 26.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.941 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.488 ' CE2' ' O ' ' A' ' 65' ' ' TYR . 17.9 p90 -174.62 178.27 1.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.07 0.462 . . . . 0.0 111.508 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.462 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 5.8 tmtm? -132.76 88.87 2.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.336 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 43.3 t -73.15 69.24 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.581 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.59 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' HB1' HG11 ' A' ' 22' ' ' VAL . . . . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.829 0.347 . . . . 0.0 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.7 t -130.79 135.34 60.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.839 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.766 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.9 mp -104.19 96.93 4.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 27.6 mtpp -60.99 -18.58 58.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 43.7 t30 172.66 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.994 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.512 ' HB3' ' CD ' ' A' ' 18' ' ' GLN . . . -156.5 138.59 14.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.008 0.433 . . . . 0.0 111.664 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.455 ' HB3' ' CE1' ' A' ' 73' ' ' PHE . 38.5 t70 -133.91 12.21 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.768 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 47.8 ttm -90.7 34.34 0.9 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.22 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.47 ' O ' ' N ' ' A' ' 16' ' ' ASP . 38.6 t 68.4 112.02 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.51 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.4 mt-10 -27.58 -39.08 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.563 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 14' ' ' SER . 1.5 m-20 -51.32 -45.64 62.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.355 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.494 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.6 mpt? -70.76 -23.24 62.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.144 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.932 ' HA ' HD11 ' A' ' 74' ' ' ILE . 63.0 mt-30 -70.8 -37.87 73.31 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -80.52 -34.57 35.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.68 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -74.93 -50.88 15.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.071 0.462 . . . . 0.0 110.404 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.5 65.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.195 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.606 HG23 ' O ' ' A' ' 18' ' ' GLN . 96.5 t -58.65 -47.67 88.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.614 0.245 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 36.5 t70 -66.63 -35.19 79.58 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.628 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.0 t -68.12 -35.2 77.75 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -77.62 -24.9 49.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.725 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -75.97 -52.89 9.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.875 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 23.5 pt20 -66.95 -26.15 66.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.969 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -65.67 -56.44 12.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.508 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.3 ptp -69.28 -18.6 63.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -82.47 -47.82 11.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.245 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -72.86 -27.96 62.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.47 ' CD2' ' OD2' ' A' ' 37' ' ' ASP . 13.1 m-85 -119.24 -170.88 2.01 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.453 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.4 ' ND2' ' O ' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -147.67 27.94 0.97 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.795 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.562 HG22 ' H ' ' A' ' 35' ' ' GLU . 7.1 mt -121.21 170.7 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.562 ' H ' HG22 ' A' ' 34' ' ' ILE . 24.5 pt-20 -114.48 23.79 12.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.779 0.323 . . . . 0.0 110.977 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -124.68 -49.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.578 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.514 ' OD1' ' HB ' ' A' ' 34' ' ' ILE . 9.4 p-10 -64.09 -27.37 69.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.537 ' O ' HD13 ' A' ' 42' ' ' ILE . 34.3 mm -61.35 -57.04 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.649 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.62 -28.83 61.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.28 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -76.96 -35.14 57.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 50.8 t80 -69.38 -30.35 68.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.78 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.537 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.1 mp -84.28 -43.51 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -66.29 -31.95 73.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.939 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 73.2 mmtt -83.45 -39.45 20.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.92 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 17.5 tp10 -54.04 -47.29 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.961 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.499 ' CD2' HD21 ' A' ' 85' ' ' LEU . 56.1 m-85 -80.05 -44.41 20.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.221 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -67.0 -9.81 42.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.75 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 44' ' ' LYS . 4.1 tppp? -81.65 -27.62 34.01 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.97 41.44 0.83 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.425 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 9.1 m-85 -132.78 -86.63 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.567 0.223 . . . . 0.0 111.022 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.59 104.78 0.16 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.515 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 31.3 Cg_exo -57.46 160.28 14.32 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.195 1.93 . . . . 0.0 111.996 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.8 m -112.38 142.52 44.82 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.303 0.641 . . . . 0.0 110.621 -0.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.475 ' HB3' HD11 ' A' ' 85' ' ' LEU . 19.5 m95 -111.08 138.2 47.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.839 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 52.8 m170 -122.03 98.15 5.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.065 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HB2' HD13 ' A' ' 85' ' ' LEU . 54.0 t -82.04 142.32 32.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.568 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.853 ' O ' HG23 ' A' ' 83' ' ' ILE . 16.5 mm -117.75 142.92 29.85 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-O 120.842 0.354 . . . . 0.0 111.773 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.737 ' O ' HG13 ' A' ' 58' ' ' VAL . 12.3 p -127.71 94.57 2.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.394 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.495 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 168.19 -94.43 0.11 Allowed Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.947 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -125.22 -85.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.574 0.225 . . . . 0.0 111.604 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.545 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -146.41 13.81 1.24 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.525 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 21.2 p90 -70.94 52.03 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 111.054 -177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.647 ' HA3' HD11 ' A' ' 84' ' ' LEU . . . -78.69 -62.0 2.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.419 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' CG ' ' A' ' 65' ' ' TYR . 21.3 m 79.58 116.58 0.06 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.565 ' CG ' ' O ' ' A' ' 64' ' ' SER . 36.1 p90 53.39 64.26 1.92 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.738 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 86' ' ' PHE . 51.8 t -94.4 -24.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.626 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 71' ' ' LYS . 87.2 m -134.82 -32.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.671 0.272 . . . . 0.0 111.555 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.72 -5.93 18.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.53 ' HG2' ' N ' ' A' ' 70' ' ' THR . 13.8 pm0 -91.01 -50.86 5.63 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.555 ' O ' ' CB ' ' A' ' 71' ' ' LYS . 4.5 t -134.4 -44.67 0.76 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.559 ' HD2' HG22 ' A' ' 67' ' ' THR . 14.2 mmmm 108.69 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.394 1.059 . . . . 0.0 110.017 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.499 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 94.3 m-70 -128.54 79.21 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.581 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.627 ' O ' ' HB2' ' A' ' 13' ' ' MET . 11.0 p90 -118.7 171.64 8.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.932 HD11 ' HA ' ' A' ' 18' ' ' GLN . 12.4 tt -168.07 111.0 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.094 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.565 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.7 m-85 -97.22 154.58 17.3 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.035 0.445 . . . . 0.0 111.576 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 15.0 p90 -170.37 123.67 0.69 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.724 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -88.18 125.77 34.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.592 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.545 HD21 HG13 ' A' ' 22' ' ' VAL . 86.6 mt -123.17 132.87 54.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.218 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.99 -100.0 0.06 OUTLIER Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.792 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.527 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.49 23.84 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.712 0.291 . . . . 0.0 111.014 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.495 HG13 ' HA2' ' A' ' 59' ' ' GLY . 46.9 t -140.64 137.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -90.9 128.66 36.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.077 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 57' ' ' ILE . 73.6 mt -118.85 137.44 52.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.516 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.647 HD11 ' HA3' ' A' ' 63' ' ' GLY . 0.7 OUTLIER -135.09 113.66 11.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.103 0.478 . . . . 0.0 111.47 179.622 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 56' ' ' CYS . 45.8 tp -98.99 141.05 32.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.67 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.725 ' HB3' HG13 ' A' ' 66' ' ' VAL . 8.0 p90 -156.44 139.86 15.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.448 0.642 . . . . 0.0 111.616 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.567 ' HD3' ' N ' ' A' ' 88' ' ' SER . 1.6 tmtp? -94.32 154.2 17.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.435 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.567 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 8.6 m -127.95 148.44 50.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.845 0.355 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.489 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.875 0.369 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.563 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.782 0.325 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 42.8 t -144.46 81.38 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.138 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.594 HG21 ' HB2' ' A' ' 11' ' ' ALA . 61.1 mt -60.75 116.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.969 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -71.95 -44.39 63.66 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.634 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 43.9 t30 -153.71 116.98 4.58 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.902 0.382 . . . . 0.0 110.941 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -103.73 84.0 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.463 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 59.5 t0 -81.1 -5.21 57.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.971 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.459 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.7 tpp -92.99 162.64 13.97 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.58 0.229 . . . . 0.0 110.444 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 13' ' ' MET . 62.9 m -40.07 -74.56 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.968 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 39.6 tt0 177.71 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.527 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.515 ' HB2' ' HE1' ' A' ' 17' ' ' MET . 59.8 m-20 -56.85 -33.08 66.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.099 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.516 ' HB3' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -75.59 -26.77 58.15 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.672 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.794 ' O ' HG23 ' A' ' 22' ' ' VAL . 62.8 mt-30 -66.33 -46.07 78.09 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -79.92 -32.55 40.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.94 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.503 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.4 t0 -72.67 -50.06 27.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB1' ' CE1' ' A' ' 76' ' ' PHE . . . -58.82 -48.83 79.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.081 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 18' ' ' GLN . 90.9 t -55.23 -53.12 38.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.917 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -71.84 -24.5 61.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.834 0.35 . . . . 0.0 110.653 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 39.1 t -72.87 -32.8 65.65 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.07 -27.55 39.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.894 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.7 m -78.2 -45.83 22.03 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.8 mt-30 -71.98 -24.92 61.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.355 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.827 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -76.0 -41.78 50.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.177 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -74.93 -29.82 61.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.688 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.544 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.4 pt-20 -82.38 -43.04 17.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.982 0.42 . . . . 0.0 110.135 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.4 ' O ' ' CD1' ' A' ' 32' ' ' TYR . 62.8 tttp -76.31 -21.35 56.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.743 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.425 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 54.7 m-85 -152.51 161.1 43.05 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.979 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -144.5 18.57 1.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.6 mm -75.77 -13.78 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.379 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 87.2 mt-10 74.94 -54.02 0.67 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.823 0.344 . . . . 0.0 110.772 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.406 ' NZ ' HG22 ' A' ' 34' ' ' ILE . 33.3 mtmm -69.75 -57.96 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.51 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.86 -27.22 17.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.305 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.827 HG23 ' HB1' ' A' ' 28' ' ' ALA . 49.3 mm -61.31 -54.22 38.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.438 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.14 -27.12 63.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -80.73 -38.78 28.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.762 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -70.42 -27.6 64.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.358 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.44 HG12 ' SG ' ' A' ' 24' ' ' CYS . 86.9 mt -79.55 -47.69 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.562 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -65.29 -38.45 90.26 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.4 tptm -57.02 -57.29 13.2 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.126 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -55.13 -51.24 67.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.225 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.49 ' CE2' HD22 ' A' ' 85' ' ' LEU . 39.8 m-85 -62.67 -25.38 68.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.713 0.292 . . . . 0.0 111.115 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -86.45 -25.99 24.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.158 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -89.9 -17.53 27.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.429 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -101.84 -61.14 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.701 0.286 . . . . 0.0 111.353 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -91.71 14.7 14.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.627 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.405 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 75.1 m-20 59.79 157.14 0.1 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.679 0.276 . . . . 0.0 110.94 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 51' ' ' ASN . 15.2 Cg_endo -57.3 172.63 0.86 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.533 2.155 . . . . 0.0 112.066 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 53' ' ' THR . 9.5 t -122.82 103.41 8.62 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.077 0.551 . . . . 0.0 110.819 0.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.682 ' HB3' HD11 ' A' ' 85' ' ' LEU . 4.5 m95 -102.12 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.486 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 78.1 t60 178.17 75.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.238 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.623 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.2 t -64.21 148.25 50.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.396 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.5 mm -114.68 146.18 19.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.604 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -133.23 77.22 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.769 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.524 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 177.76 -81.2 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.521 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 55.9 mtp85 -142.72 -80.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.748 0.309 . . . . 0.0 111.288 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.488 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.3 14.43 0.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.761 -179.618 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.76 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -51.66 -25.67 7.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.341 . . . . 0.0 111.263 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.34 51.96 0.84 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.023 -0.608 . . . . 0.0 111.728 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.0 p -85.78 60.48 6.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.057 0.456 . . . . 0.0 111.178 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 13.8 m-85 -89.47 30.7 0.98 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.685 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 73' ' ' PHE . 66.3 t -46.84 -77.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.9 m -53.08 -30.55 36.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.522 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -56.78 -20.98 25.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.866 0.365 . . . . 0.0 110.258 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.618 ' HG3' ' HB2' ' A' ' 88' ' ' SER . 0.3 OUTLIER -82.39 -73.62 0.39 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.357 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.843 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.5 t -175.61 -86.64 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.406 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.843 ' H ' HG23 ' A' ' 70' ' ' THR . 13.9 tptt -163.47 26.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.992 0.425 . . . . 0.0 110.373 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -122.88 75.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.585 ' HB3' HG13 ' A' ' 66' ' ' VAL . 9.3 p90 -119.23 -176.25 3.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.192 0.52 . . . . 0.0 111.858 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.516 HG21 ' HB3' ' A' ' 17' ' ' MET . 7.9 tt 177.68 111.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.421 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.634 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 9.3 p90 -123.99 147.93 47.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.289 0.566 . . . . 0.0 111.986 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.6 ' HE2' HD11 ' A' ' 78' ' ' LEU . 2.0 p90 -140.37 170.14 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.846 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.4 ' O ' HD23 ' A' ' 78' ' ' LEU . 3.1 t80 -121.21 137.72 54.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.726 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.6 HD11 ' HE2' ' A' ' 76' ' ' PHE . 84.3 mt -131.36 130.88 43.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.116 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.7 -92.09 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.806 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.664 ' NE2' HG23 ' A' ' 81' ' ' VAL . 2.0 pp0? -138.46 33.82 2.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.996 0.426 . . . . 0.0 110.94 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.664 HG23 ' NE2' ' A' ' 80' ' ' GLN . 87.8 t -138.38 150.59 24.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.556 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.92 118.68 36.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.123 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.817 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.5 mp -105.07 132.97 50.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -137.61 124.51 21.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.104 0.478 . . . . 0.0 111.487 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.682 HD11 ' HB3' ' A' ' 54' ' ' TRP . 33.2 tp -119.74 137.47 53.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.876 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 2.8 p90 -137.68 152.65 49.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.181 0.515 . . . . 0.0 111.965 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.537 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 6.4 tmtm? -124.94 127.93 47.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.155 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.802 ' HA ' HG22 ' A' ' 70' ' ' THR . 29.0 t -96.22 151.3 19.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.623 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.554 179.791 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.439 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.776 0.322 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 44.3 t -134.04 105.34 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.43 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.702 HD13 ' HG3' ' A' ' 18' ' ' GLN . 67.6 mt -82.58 113.94 22.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.955 0.407 . . . . 0.0 110.585 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -78.8 -34.3 45.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.955 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -169.88 110.73 0.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -125.3 137.32 54.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.974 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -140.88 2.03 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.51 ' O ' ' HG2' ' A' ' 13' ' ' MET . 50.2 ttp -94.19 58.87 2.56 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.781 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.9 t 64.18 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.02 0.438 . . . . 0.0 111.283 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.538 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -35.08 -34.51 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.853 179.615 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -50.9 -39.19 53.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.853 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.414 ' HG2' ' CE ' ' A' ' 13' ' ' MET . 0.9 OUTLIER -68.77 -25.31 64.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.245 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.702 ' HG3' HD13 ' A' ' 8' ' ' ILE . 2.8 mp0 -68.57 -42.91 77.62 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -79.05 -32.07 44.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.393 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -77.11 -50.19 13.59 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.896 0.379 . . . . 0.0 110.636 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.78 80.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.874 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -63.07 -41.05 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.726 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -68.11 -39.68 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 81.1 m -67.71 -32.78 73.66 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -78.29 -25.55 46.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.469 177.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 99.0 m -74.97 -55.24 5.97 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -65.36 -26.63 68.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.212 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.523 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -67.54 -46.55 72.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.613 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.52 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 1.6 tpt -70.06 -27.02 64.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.749 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -83.31 -43.22 16.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.027 0.442 . . . . 0.0 110.125 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -77.86 -22.54 49.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.919 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -133.79 150.05 51.43 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.741 0.305 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -116.37 29.83 7.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.022 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.711 HG22 ' H ' ' A' ' 35' ' ' GLU . 4.9 mt -123.55 176.35 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.711 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.2 mt-10 -109.18 14.73 23.7 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.775 0.321 . . . . 0.0 110.786 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.551 ' HA ' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -113.99 -58.9 2.09 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.288 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -53.52 -25.76 18.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.903 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.523 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 40.4 mm -64.0 -59.94 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.465 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.457 ' HB2' ' HB ' ' A' ' 58' ' ' VAL . . . -58.05 -29.91 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.97 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.524 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -71.69 -42.78 67.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.376 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 5.5 t80 -66.78 -27.8 67.88 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.92 0.391 . . . . 0.0 110.256 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -79.06 -50.39 18.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.184 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.524 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.2 pttm -71.23 -27.78 63.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.407 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 55.9 mtpt -71.26 -48.12 52.96 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.648 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -61.39 -37.56 83.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.734 0.302 . . . . 0.0 110.818 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.586 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.7 m-85 -83.29 -19.54 36.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.755 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.4 -36.72 16.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.72 0.295 . . . . 0.0 111.395 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 4.0 mptp? -90.27 29.21 1.28 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.363 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -145.86 -44.37 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -104.79 5.79 33.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.45 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 m120 61.61 154.0 0.11 Allowed Pre-proline 0 C--N 1.333 -0.141 0 CA-C-O 120.766 0.317 . . . . 0.0 110.886 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 50.9 Cg_exo -54.01 174.77 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.579 2.186 . . . . 0.0 112.173 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.9 m -126.84 97.22 4.9 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 123.118 0.567 . . . . 0.0 110.455 -0.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.632 ' HB2' ' O ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -150.9 -179.08 6.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.889 -179.733 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.646 ' O ' HD12 ' A' ' 85' ' ' LEU . 19.8 p-80 -179.51 -179.63 0.54 Allowed 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 120.935 0.397 . . . . 0.0 111.043 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 31.9 p -116.91 153.33 32.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.357 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.688 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.4 mm -94.38 147.63 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.294 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.712 ' O ' HG13 ' A' ' 58' ' ' VAL . 11.4 p -122.19 72.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.534 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.77 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.52 -78.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.376 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -149.79 -82.09 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.7 0.286 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.486 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 13.02 0.35 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.775 -179.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.615 ' CE1' HG23 ' A' ' 57' ' ' ILE . 4.1 p90 -55.97 -20.29 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -129.14 50.04 0.9 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.732 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.5 m -50.11 -87.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.79 -0.241 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 58.38 61.46 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.004 0.431 . . . . 0.0 110.72 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 66' ' ' VAL . 43.8 t -116.64 -0.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.838 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -111.37 -28.1 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.777 0.322 . . . . 0.0 111.172 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.586 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 90.4 m-70 -48.37 -27.73 2.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.178 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.586 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 16.6 pt-20 155.22 45.85 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.819 0.447 . . . . 0.0 110.735 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.57 HG21 HG13 ' A' ' 66' ' ' VAL . 22.9 m -92.31 -85.96 0.25 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.516 -179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 70' ' ' THR . 31.1 mmmt 76.12 -12.32 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.074 -179.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.492 ' H ' HG22 ' A' ' 70' ' ' THR . 19.9 m80 -132.89 81.45 1.94 Allowed 'General case' 0 C--O 1.23 0.076 0 CA-C-O 120.962 0.411 . . . . 0.0 110.25 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 13' ' ' MET . 17.7 p90 -115.47 -177.08 3.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.651 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.0 tt -168.55 123.24 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.05 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.906 ' CD1' HD23 ' A' ' 84' ' ' LEU . 61.4 m-85 -101.76 137.27 40.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 1.3 p90 -159.03 117.54 2.92 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.085 0.469 . . . . 0.0 111.281 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.448 ' O ' HD23 ' A' ' 78' ' ' LEU . 48.8 t80 -84.53 136.78 33.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.924 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.548 HD12 HD12 ' A' ' 83' ' ' ILE . 90.0 mt -136.58 123.68 21.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.922 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 54.05 -106.61 0.5 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.541 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.444 ' OE1' HG23 ' A' ' 81' ' ' VAL . 1.6 pp0? -125.46 33.72 5.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 111.352 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.77 HG13 ' HA2' ' A' ' 59' ' ' GLY . 89.0 t -155.46 124.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.601 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.64 131.61 34.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.9 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.688 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.6 mt -110.02 138.72 36.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.532 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.906 HD23 ' CD1' ' A' ' 75' ' ' TYR . 2.8 tm? -135.75 115.59 13.06 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.927 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 55' ' ' HIS . 56.0 tp -96.91 136.84 36.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.605 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.632 ' O ' ' HB2' ' A' ' 54' ' ' TRP . 23.6 p90 -142.3 123.64 14.77 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.675 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 54' ' ' TRP . 1.6 tmtp? -84.96 69.3 10.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 47.6 t -76.75 63.66 2.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.539 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.849 0.357 . . . . 0.0 110.975 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.529 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 57.9 t -123.68 134.37 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.113 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.806 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.0 mp -112.35 101.05 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.177 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.477 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 33.3 mmtp -54.74 -23.14 16.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.87 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 45.1 t30 177.44 119.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.691 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.596 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -94.94 95.62 8.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.852 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.456 ' HB2' ' CE1' ' A' ' 73' ' ' PHE . 65.7 t0 -82.08 -33.31 29.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.153 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.533 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 50.9 tpp -78.01 162.22 26.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.713 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.424 ' N ' ' HG3' ' A' ' 13' ' ' MET . 43.0 t -39.67 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.126 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.44 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -178.5 -29.68 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.18 -34.58 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.739 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 24.0 mmt -74.9 -24.82 58.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.666 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 74' ' ' ILE . 3.2 mp0 -67.5 -45.14 76.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -81.04 -31.44 34.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.241 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 46' ' ' PHE . 10.2 t0 -77.03 -50.19 13.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.342 . . . . 0.0 110.681 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.771 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -65.57 -48.09 73.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.318 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 18' ' ' GLN . 88.7 t -62.44 -46.16 97.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 66.3 t0 -72.0 -34.87 69.22 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 121.138 -0.225 . . . . 0.0 110.702 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 48.9 t -68.9 -33.68 74.17 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.21 -27.08 53.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.523 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 92.7 m -74.96 -53.53 8.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.004 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 24.4 pt20 -68.32 -23.28 64.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.93 -47.82 56.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.915 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -72.21 -27.14 62.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.16 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -79.44 -46.25 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HG3' ' CE1' ' A' ' 32' ' ' TYR . 16.9 tppt? -82.37 -24.19 34.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.51 ' CE1' ' HG3' ' A' ' 31' ' ' LYS . 7.6 m-85 -134.77 156.24 49.2 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.844 0.354 . . . . 0.0 110.621 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -143.86 23.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.115 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.9 mm -78.07 -16.55 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.59 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 86.4 mt-10 76.71 -54.12 0.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -76.51 -50.32 14.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.357 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.407 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 66.3 t0 -56.14 -29.84 61.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.945 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.634 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.4 mm -58.01 -53.05 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.351 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.594 ' HB2' ' CG2' ' A' ' 58' ' ' VAL . . . -62.25 -24.16 67.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.947 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.14 -38.09 27.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -70.82 -24.42 62.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.536 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.429 HG21 ' SG ' ' A' ' 56' ' ' CYS . 79.6 mt -84.91 -46.27 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 43' ' ' LYS . 5.3 tmtm? -64.31 -37.71 88.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.686 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 12.2 tppt? -70.71 -56.49 6.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.436 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -49.44 -40.17 35.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.512 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.695 ' CE2' HD22 ' A' ' 85' ' ' LEU . 19.2 m-85 -68.37 -51.3 45.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.23 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -68.62 -9.82 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.455 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -59.67 -28.32 67.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.502 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -164.07 32.14 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 3.4 m-85 -125.85 10.65 7.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.621 0.248 . . . . 0.0 111.196 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 62.99 134.64 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.785 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HB2' ' HB ' ' A' ' 53' ' ' THR . 54.8 Cg_endo -70.11 166.89 26.53 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.329 2.019 . . . . 0.0 112.099 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' A' ' 52' ' ' PRO . 8.8 t -130.75 122.35 27.09 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.234 0.614 . . . . 0.0 110.638 -0.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 54' ' ' TRP . 6.1 m95 -100.12 160.3 14.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.256 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 89.7 m-70 -131.58 62.38 1.63 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.449 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.4 t -55.53 106.95 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.834 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.789 ' O ' HG23 ' A' ' 83' ' ' ILE . 25.1 mm -82.29 153.93 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.819 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.594 ' CG2' ' HB2' ' A' ' 39' ' ' ALA . 60.6 t -141.15 68.07 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.93 0.395 . . . . 0.0 110.739 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -174.33 -76.93 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.574 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.9 mtp85 -149.84 -77.91 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.725 0.298 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.5 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -154.96 14.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.608 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.542 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 28.3 p90 -56.98 -16.31 6.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.13 51.58 0.85 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.507 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.654 ' O ' HG23 ' A' ' 66' ' ' VAL . 45.9 t -44.7 -76.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.316 . . . . 0.0 111.631 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 42.59 31.57 0.3 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.489 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.672 HG21 ' OH ' ' A' ' 75' ' ' TYR . 45.2 t -97.53 -2.84 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.8 m -114.01 -27.41 7.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.822 0.344 . . . . 0.0 111.09 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.577 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 25.5 t-80 -48.28 -27.86 2.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 15.5 pt-20 157.13 44.75 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.422 0.452 . . . . 0.0 111.396 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.748 HG22 ' H ' ' A' ' 72' ' ' HIS . 73.8 m -86.77 -81.89 0.22 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.333 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 70' ' ' THR . 46.7 mmtm 75.91 -3.73 2.51 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.649 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.748 ' H ' HG22 ' A' ' 70' ' ' THR . 0.3 OUTLIER -156.48 92.87 1.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.188 0.518 . . . . 0.0 110.716 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.502 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 8.3 p90 -122.62 -170.86 2.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.135 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.71 HD12 ' OE1' ' A' ' 18' ' ' GLN . 5.5 tt -162.42 110.94 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.567 178.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.806 ' O ' HG23 ' A' ' 8' ' ' ILE . 10.7 m-30 -99.51 140.12 34.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.457 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.771 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.1 p90 -170.17 127.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.101 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.529 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 8.3 p90 -114.47 145.98 41.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.212 0.53 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 6' ' ' ALA . 81.7 mt -115.58 117.59 30.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.495 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -77.31 0.2 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.413 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.479 HE21 HG23 ' A' ' 81' ' ' VAL . 3.1 pm0 -149.56 24.93 0.87 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.479 HG23 HE21 ' A' ' 80' ' ' GLN . 48.1 t -134.14 118.5 28.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.873 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.515 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -92.04 122.78 34.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 112.063 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.789 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.3 mp -100.47 133.29 44.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.187 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.73 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.4 mp -120.1 97.99 5.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 111.569 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.695 HD22 ' CE2' ' A' ' 46' ' ' PHE . 49.8 tp -98.69 134.62 41.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.692 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.502 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 7.0 p90 -171.89 163.96 6.32 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.626 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HB3' ' NE2' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -113.77 81.21 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.609 179.109 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 89.3 p -69.02 67.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.843 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.34 -1.256 . . . . 0.0 112.52 179.889 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.875 0.369 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.563 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.782 0.325 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.2 t -135.14 90.74 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.689 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -80.88 91.09 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 66.8 mttm -58.79 -20.09 46.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.541 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 19.9 t-20 173.47 129.66 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.675 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.45 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -146.62 128.74 15.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -131.73 2.91 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 55.8 ttp -96.47 62.57 2.05 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.934 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 t 64.56 110.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.44 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.511 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.0 mt-10 -40.45 -32.77 0.21 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.246 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -53.94 -35.07 61.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.403 ' HB2' HD12 ' A' ' 74' ' ' ILE . 26.2 mmt -70.91 -24.42 62.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 3.5 mp0 -71.04 -41.11 71.24 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -77.8 -33.41 52.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.751 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -76.3 -52.52 9.81 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 120.971 0.415 . . . . 0.0 110.668 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.85 -49.94 75.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' GLN . 94.4 t -60.37 -51.37 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.46 -29.28 69.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.74 0.305 . . . . 0.0 110.453 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 46.4 t -71.66 -32.3 67.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.44 -23.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.026 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.0 m -80.56 -44.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -74.45 -28.08 60.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.252 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -74.13 -50.18 20.54 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.4 tpt -68.46 -25.96 65.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.616 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -80.64 -47.22 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.065 0.459 . . . . 0.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -73.88 -25.03 59.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.678 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -144.28 152.27 40.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.818 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -136.93 46.22 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 33.7 mt -98.18 -16.69 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.432 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 46.1 mm-40 77.94 -54.84 0.51 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.864 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -74.42 -52.93 10.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -55.75 -29.36 59.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.28 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.423 HG23 ' HB1' ' A' ' 28' ' ' ALA . 47.5 mm -60.07 -50.05 81.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.713 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.6 -20.94 63.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.201 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -82.68 -40.52 20.56 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.832 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -70.76 -26.23 63.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.194 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 85.3 mt -83.41 -46.22 18.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 35.2 ttmt -63.81 -37.69 88.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.267 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 12.8 mmmm -75.23 -31.86 60.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -58.96 -58.89 6.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.72 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.441 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 46.5 m-85 -69.91 -30.71 68.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 62.7 t0 -64.65 -34.12 77.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.964 0.411 . . . . 0.0 110.96 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.551 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -90.27 30.43 1.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.816 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -152.75 -43.49 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.352 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.57 0.45 15.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.757 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 5.3 m120 62.71 156.82 0.12 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.711 0.291 . . . . 0.0 111.287 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.429 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 11.2 Cg_endo -54.49 173.52 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.862 2.375 . . . . 0.0 112.212 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.429 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 89.7 m -117.8 128.16 54.59 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.226 0.611 . . . . 0.0 110.463 -0.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.662 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 3.1 m95 -119.3 -168.67 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.053 0.454 . . . . 0.0 111.047 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -168.25 63.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.407 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.894 ' SG ' HD13 ' A' ' 85' ' ' LEU . 60.1 m -48.4 138.34 10.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.113 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.796 ' O ' HG23 ' A' ' 83' ' ' ILE . 20.0 mm -114.48 140.99 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.743 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.1 76.95 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.95 179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.74 -66.93 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.284 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.763 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 99.4 mtt180 -154.97 -80.9 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.741 0.305 . . . . 0.0 111.057 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.507 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.92 17.88 0.12 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.324 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.684 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 25.1 p90 -52.8 -20.7 3.42 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 65' ' ' TYR . . . -58.52 -60.59 8.66 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.158 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p 49.6 26.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 13.8 m-30 -111.81 41.37 1.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.922 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.55 HG21 ' OH ' ' A' ' 75' ' ' TYR . 49.0 t -75.53 -71.34 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.815 0.34 . . . . 0.0 111.301 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.5 m -76.97 -28.65 55.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.219 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.401 ' ND1' ' O ' ' A' ' 68' ' ' HIS . 26.1 t-80 -54.63 -21.05 9.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.198 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 88' ' ' SER . 10.3 pt-20 -110.01 -55.23 2.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.478 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.645 HG22 ' N ' ' A' ' 71' ' ' LYS . 28.3 m -162.89 -101.71 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.074 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.645 ' N ' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 179.95 25.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.789 0.328 . . . . 0.0 111.383 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.464 ' CE1' ' HE3' ' A' ' 71' ' ' LYS . 92.2 m-70 -107.83 68.02 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.967 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 13' ' ' MET . 36.7 p90 -107.04 -174.99 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.216 0.532 . . . . 0.0 111.425 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.585 HG23 ' O ' ' A' ' 74' ' ' ILE . 12.2 tt -169.65 109.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.5 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.55 ' OH ' HG21 ' A' ' 66' ' ' VAL . 56.1 m-85 -89.83 138.85 31.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.762 0.315 . . . . 0.0 111.186 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.642 ' CZ ' HG22 ' A' ' 83' ' ' ILE . 1.9 p90 -166.39 112.13 0.83 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 0.0 110.824 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -91.88 129.36 37.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.3 mt -119.29 134.94 54.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 0.0 111.211 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.18 -103.92 0.14 Allowed Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.798 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.65 ' NE2' HG23 ' A' ' 81' ' ' VAL . 2.0 pp0? -128.12 33.04 4.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.921 0.391 . . . . 0.0 111.189 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.65 HG23 ' NE2' ' A' ' 80' ' ' GLN . 88.6 t -146.06 140.64 21.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.581 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.763 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -93.25 131.69 38.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.796 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.796 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.0 mt -127.4 132.54 69.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.455 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.655 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -144.78 127.38 16.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.056 0.455 . . . . 0.0 111.579 -179.442 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.894 HD13 ' SG ' ' A' ' 56' ' ' CYS . 29.8 tp -109.11 141.04 41.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.602 ' H ' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -157.97 154.73 28.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.003 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.662 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -140.41 154.18 46.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.013 0.435 . . . . 0.0 111.688 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 92.9 p -81.28 76.86 8.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.079 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.516 ' HA3' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.329 -1.262 . . . . 0.0 112.766 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.826 0.346 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.45 HG12 ' HE2' ' A' ' 9' ' ' LYS . 46.2 t -144.36 88.68 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.028 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.575 HD13 ' HG3' ' A' ' 18' ' ' GLN . 79.5 mt -59.41 129.15 21.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 7' ' ' VAL . 75.2 mmtt -112.02 -23.11 10.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.188 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -165.48 85.6 0.37 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.882 0.372 . . . . 0.0 110.863 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.431 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -106.97 95.69 5.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.878 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.51 -11.16 59.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.368 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.484 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 43.4 tpp -78.34 158.73 28.72 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.708 0.29 . . . . 0.0 110.735 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -41.63 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.205 -179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.476 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 44.7 tt0 -178.27 -31.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.58 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -55.42 -32.17 62.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.844 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.484 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.1 mpt? -77.24 -24.84 51.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.563 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.662 ' OE1' HD12 ' A' ' 74' ' ' ILE . 2.0 mp0 -66.67 -45.46 78.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.21 -32.1 29.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.308 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.7 t0 -75.35 -47.55 27.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 110.656 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -66.45 -49.14 67.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.139 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 18' ' ' GLN . 86.2 t -60.23 -41.61 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.79 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -77.12 -31.68 55.93 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.625 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 37.9 t -72.07 -29.81 64.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.1 -26.89 33.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.977 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.3 m -78.9 -45.78 19.85 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.728 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -72.35 -28.35 62.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.743 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -67.53 -56.17 10.59 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.391 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 67.1 mtm -70.11 -20.15 63.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.643 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -81.14 -45.03 17.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -83.78 -26.33 29.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.7 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -137.65 170.03 16.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -154.48 54.79 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 21.4 mt -108.11 -11.11 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.477 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 7.9 mp0 72.69 -54.47 0.69 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.093 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -75.69 -50.23 16.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.406 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 7.6 t70 -57.16 -29.1 63.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.418 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.743 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.6 mm -60.9 -49.79 83.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.476 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.78 -23.66 63.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.474 ' HA ' ' HG3' ' A' ' 43' ' ' LYS . . . -75.99 -45.09 36.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.195 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.4 t80 -67.68 -25.82 65.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.902 0.382 . . . . 0.0 110.391 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.6 mt -80.92 -49.46 18.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.908 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.531 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -68.33 -31.48 70.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.072 179.068 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 29.7 mmmt -72.51 -42.32 64.94 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.316 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -70.35 -27.88 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.437 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.501 ' CD2' HD21 ' A' ' 85' ' ' LEU . 32.2 m-85 -89.01 -38.87 14.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.539 0.209 . . . . 0.0 111.502 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.62 -25.43 49.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.0 111.175 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -87.17 -11.97 48.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.193 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -110.22 -53.68 2.65 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.665 0.269 . . . . 0.0 111.21 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 52.5 m-85 -94.97 16.54 15.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.637 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.412 ' OD1' ' HD2' ' A' ' 52' ' ' PRO . 45.6 t30 62.61 138.68 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.55 0.214 . . . . 0.0 110.851 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OD1' ' A' ' 51' ' ' ASN . 53.2 Cg_exo -55.52 172.49 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.248 1.965 . . . . 0.0 112.125 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.0 m -120.97 125.61 47.82 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.134 0.574 . . . . 0.0 110.789 0.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.452 ' CZ2' ' HG3' ' A' ' 87' ' ' LYS . 8.9 m95 -114.08 174.36 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.516 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.408 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 92.2 m-70 -157.52 92.58 1.23 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.078 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.888 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -79.24 137.71 37.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.534 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.844 ' O ' HG23 ' A' ' 83' ' ' ILE . 13.8 mm -112.73 145.88 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 120.748 0.308 . . . . 0.0 111.508 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.1 p -123.61 75.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.684 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.711 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -178.06 -88.95 0.07 OUTLIER Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.735 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -135.29 -84.16 0.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.641 0.258 . . . . 0.0 111.318 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.499 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -151.11 12.79 0.67 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.651 -179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.6 p90 -60.01 -14.86 18.26 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.432 ' HA3' ' CD1' ' A' ' 57' ' ' ILE . . . -117.14 43.47 1.63 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.013 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.7 p -97.12 63.72 1.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.887 0.375 . . . . 0.0 110.635 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -119.99 45.15 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.54 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.831 HG13 ' HB3' ' A' ' 88' ' ' SER . 97.4 t -130.82 -38.22 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.898 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -49.61 -27.31 4.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.32 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 79.1 t60 -81.92 5.97 17.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.869 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 17.5 tp10 -114.61 -33.91 5.38 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.784 0.325 . . . . 0.0 111.456 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.771 HG22 ' HD3' ' A' ' 71' ' ' LYS . 18.9 m -158.96 -95.97 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.887 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.771 ' HD3' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 156.36 2.23 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 178.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.426 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 20.3 m80 -79.2 60.96 3.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.162 0.506 . . . . 0.0 109.93 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 40.3 p90 -111.83 -168.14 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.926 -178.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.662 HD12 ' OE1' ' A' ' 18' ' ' GLN . 7.1 tt -168.57 148.99 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.265 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -128.19 153.15 47.22 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.006 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.672 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 19.0 p90 -170.2 123.96 0.72 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.358 0.599 . . . . 0.0 111.354 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -84.41 118.81 24.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.154 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 6' ' ' ALA . 85.6 mt -116.32 117.63 30.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.716 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.48 -105.75 0.79 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.338 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.64 ' NE2' HG23 ' A' ' 81' ' ' VAL . 1.9 pp0? -126.36 30.19 5.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 111.269 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.711 HG13 ' HA2' ' A' ' 59' ' ' GLY . 85.2 t -142.53 133.81 24.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.37 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.53 118.51 31.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.844 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.6 mp -103.11 137.04 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.009 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.677 HD12 ' CZ ' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -137.31 116.22 12.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.168 0.509 . . . . 0.0 111.899 -179.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.888 HD13 ' HB2' ' A' ' 56' ' ' CYS . 63.9 tp -107.18 135.27 48.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.364 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.677 ' CZ ' HD12 ' A' ' 84' ' ' LEU . 1.5 m-85 -130.75 176.12 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 0.0 112.24 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.452 ' HG3' ' CZ2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -141.82 85.62 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.474 179.433 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.831 ' HB3' HG13 ' A' ' 66' ' ' VAL . 99.1 p -71.07 108.0 4.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.818 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' ' HG3' ' A' ' 69' ' ' GLU . . . . . . . . 0 C--O 1.249 1.08 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.558 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.883 0.373 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.526 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 24.0 t -133.14 152.13 35.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.61 HD11 ' CG2' ' A' ' 22' ' ' VAL . 37.5 mt -115.74 114.95 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.509 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -75.02 -38.24 61.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.1 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.614 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 0.9 OUTLIER -164.0 119.0 1.54 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.851 0.358 . . . . 0.0 110.73 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -143.89 140.03 29.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.373 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -131.9 7.68 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.619 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 52.2 tpp -72.0 62.96 0.47 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.981 0.42 . . . . 0.0 111.409 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 42.2 t 68.34 -63.22 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.414 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.563 ' HB2' ' O ' ' A' ' 14' ' ' SER . 41.2 tt0 150.56 -49.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.702 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -52.89 -24.87 10.08 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.873 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.8 mpt? -81.85 -25.22 35.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.28 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.679 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.9 mt-30 -65.75 -42.27 91.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -74.94 -39.79 61.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.185 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.58 -53.81 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.908 0.385 . . . . 0.0 110.764 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.55 -51.48 65.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.309 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 18' ' ' GLN . 70.7 t -56.46 -53.76 36.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -68.46 -23.26 64.57 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.854 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.5 t -72.6 -34.09 67.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.72 -27.06 44.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.827 178.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.524 HG22 ' OE2' ' A' ' 30' ' ' GLU . 89.9 m -77.06 -49.28 15.69 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.954 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -69.67 -25.6 63.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.285 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.572 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -72.63 -42.04 64.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.535 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.6 ttm -71.5 -31.26 66.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.738 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.524 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.2 mt-10 -79.35 -46.78 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.264 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -77.04 -21.47 54.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.405 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 50.8 m-85 -144.37 149.43 36.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.842 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -136.85 43.22 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.029 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.6 mt -99.43 -16.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.418 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.4 mt-10 77.55 -54.81 0.53 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.005 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -75.33 -50.84 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.256 179.577 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.84 -28.12 54.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.08 0.467 . . . . 0.0 110.112 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -61.94 -57.87 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.416 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.15 -24.46 58.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.926 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -77.81 -42.45 33.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.017 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -69.41 -21.91 63.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.3 mt -81.62 -50.36 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.503 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 18.6 ptpt -66.17 -38.64 88.55 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.662 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 1.1 mptm? -65.53 -45.87 81.77 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.58 -44.44 76.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -74.34 -32.47 62.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.389 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.406 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 47.5 m-20 -74.32 -26.69 60.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.698 0.285 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -88.74 -15.62 34.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.512 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -111.96 -26.94 8.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.537 0.208 . . . . 0.0 111.311 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -117.96 1.94 12.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.538 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 61.73 153.46 0.11 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.69 0.281 . . . . 0.0 111.005 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 170.91 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.643 2.229 . . . . 0.0 112.145 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -117.74 119.89 36.29 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.05 0.54 . . . . 0.0 110.294 -0.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.608 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 21.9 m95 -108.63 -172.28 2.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.227 0.537 . . . . 0.0 111.596 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.433 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 15.3 t-160 -171.77 115.44 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.911 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -102.09 145.58 29.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.954 0.407 . . . . 0.0 111.33 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.867 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 27.3 mm -111.71 143.13 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.603 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.673 ' O ' HG13 ' A' ' 58' ' ' VAL . 7.2 p -129.88 58.91 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.566 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -148.02 -109.74 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.859 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 37.6 mmt180 -123.43 -65.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.86 0.362 . . . . 0.0 111.38 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.577 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.06 20.81 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.55 -179.361 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 15.0 p90 -76.32 17.04 0.39 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.562 -177.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.422 ' HA3' HG13 ' A' ' 57' ' ' ILE . . . -87.63 28.69 5.73 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.016 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -71.87 57.71 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.258 0.552 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.568 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 65.9 t80 -146.28 24.53 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.347 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.769 HG11 ' HB3' ' A' ' 73' ' ' PHE . 43.6 t -85.96 -54.99 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.774 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 89.5 m -50.91 -32.8 21.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.055 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -54.57 -23.41 16.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.217 0.532 . . . . 0.0 109.728 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.532 ' HB3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -93.71 -76.34 0.48 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.219 179.06 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.837 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -163.45 -107.95 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.818 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.527 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -153.2 32.21 0.47 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.001 0.429 . . . . 0.0 110.899 179.298 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.443 ' C ' ' HE2' ' A' ' 13' ' ' MET . 37.9 m170 -109.24 72.16 0.8 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.451 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.769 ' HB3' HG11 ' A' ' 66' ' ' VAL . 30.5 p90 -106.04 -172.14 2.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.293 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.677 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.1 tt 166.37 107.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.007 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.614 ' CE2' ' HB3' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -119.24 163.68 16.75 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.162 0.506 . . . . 0.0 111.619 178.855 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 7' ' ' VAL . 5.9 p90 -155.09 162.49 41.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.742 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -119.3 133.46 55.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.053 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.909 ' O ' HD12 ' A' ' 78' ' ' LEU . 2.9 pp -140.47 141.0 35.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.979 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.57 -97.25 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.636 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -141.19 29.62 1.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.914 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -140.72 133.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.862 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.608 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -100.0 128.62 46.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.01 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 57' ' ' ILE . 65.9 mt -115.51 138.26 46.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.629 ' C ' HD23 ' A' ' 84' ' ' LEU . 5.4 tt -130.18 117.04 19.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.612 -179.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.539 ' HB3' HG23 ' A' ' 74' ' ' ILE . 66.1 tp -109.7 144.17 38.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.553 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.665 ' CG ' HG22 ' A' ' 66' ' ' VAL . 3.8 p90 -165.06 179.79 6.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.608 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -168.85 -177.98 3.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.132 0.491 . . . . 0.0 111.752 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.837 ' HA ' HG22 ' A' ' 70' ' ' THR . 78.5 p -111.57 76.66 0.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.249 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.478 ' N ' ' HD3' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.511 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.508 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.888 0.375 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -141.06 104.72 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.695 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -81.81 91.63 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.916 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -57.16 -19.18 18.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.722 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 49.5 t30 179.17 130.96 0.08 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.359 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -120.92 130.66 53.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.594 -179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -132.58 3.39 3.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.451 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.653 ' HE2' ' HG2' ' A' ' 17' ' ' MET . 68.3 mmm -97.45 49.07 1.04 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.028 0.442 . . . . 0.0 111.669 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.488 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 51.1 m 70.48 -63.05 0.42 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.715 178.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.668 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 10.2 pt-20 159.23 -42.25 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.651 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -52.5 -33.2 43.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.995 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.653 ' HG2' ' HE2' ' A' ' 13' ' ' MET . 1.1 mpt? -72.64 -28.29 62.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.199 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.769 ' HA ' HD11 ' A' ' 74' ' ' ILE . 55.8 mm-40 -63.26 -50.14 71.31 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.54 -34.02 64.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.081 179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.444 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 39.1 t70 -74.89 -64.18 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 110.463 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -49.3 -46.26 46.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.32 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 18' ' ' GLN . 53.8 t -59.29 -54.61 31.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.984 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.76 -29.07 69.89 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.636 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.8 m -71.32 -34.0 70.17 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -28.45 51.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.62 178.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.604 HG22 ' OE2' ' A' ' 30' ' ' GLU . 86.7 m -74.58 -51.39 14.71 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.609 179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.448 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -68.1 -23.96 64.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.367 178.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.557 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.5 -46.57 63.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 93.6 mmm -70.45 -29.83 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.968 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.604 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.6 mt-10 -78.39 -47.71 17.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.356 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -75.8 -21.23 57.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.75 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -140.76 140.1 34.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.858 0.361 . . . . 0.0 111.03 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -111.02 29.28 7.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.5 mt -116.46 172.27 4.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.609 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.3 mt-10 -111.03 15.12 21.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.712 0.291 . . . . 0.0 111.296 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -119.48 -52.96 2.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.836 0.35 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.81 -23.51 52.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.012 0.434 . . . . 0.0 109.912 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.557 HG23 ' HB1' ' A' ' 28' ' ' ALA . 37.3 mm -65.57 -57.34 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.681 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.67 62.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -83.86 -41.55 17.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.966 0.412 . . . . 0.0 110.959 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.453 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -73.35 -22.55 60.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -86.39 -43.05 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.381 0.61 . . . . 0.0 109.459 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.532 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -71.66 -37.09 70.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.728 179.111 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.5 mttt -75.7 -44.03 44.21 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.3 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . 37.6 tt0 -61.69 -36.48 81.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.9 m-85 -74.92 -40.62 60.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.64 0.257 . . . . 0.0 111.517 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.99 -14.46 60.23 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 45' ' ' GLU . 4.0 ptpp? -82.91 3.94 27.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.929 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -152.25 -44.79 0.1 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.444 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -78.69 -4.1 47.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.372 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 62.99 141.62 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.707 0.289 . . . . 0.0 110.709 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.9 170.67 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.366 2.044 . . . . 0.0 112.163 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 53' ' ' THR . 7.6 t -120.97 111.51 17.59 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.089 0.556 . . . . 0.0 110.576 -0.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 10.3 m95 -101.46 168.49 9.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.06 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -151.81 99.48 2.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.758 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.885 ' HB3' HD13 ' A' ' 85' ' ' LEU . 29.4 p -90.78 130.0 36.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.84 ' O ' HG23 ' A' ' 83' ' ' ILE . 11.9 mm -109.3 149.6 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 49.0 t -134.79 90.07 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.984 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.466 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 175.56 -74.12 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.332 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 56.0 mtp85 -153.11 -78.64 0.11 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.887 0.375 . . . . 0.0 111.279 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.565 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.01 24.22 0.11 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.758 -179.572 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.504 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.8 p90 -67.83 8.58 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -64.95 -67.01 2.19 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.282 -0.961 . . . . 0.0 111.945 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 24.9 m 78.55 41.04 0.11 Allowed 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.416 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 5.3 p90 -179.31 65.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.807 0.337 . . . . 0.0 111.026 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.606 HG21 ' OH ' ' A' ' 75' ' ' TYR . 44.6 t -97.58 -63.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.202 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -90.71 -27.94 18.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.905 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -52.68 -22.2 4.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.311 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' HG22 ' A' ' 70' ' ' THR . 22.5 pt-20 -90.44 -59.56 2.15 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.225 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.674 HG22 ' HA ' ' A' ' 88' ' ' SER . 4.6 t -147.4 -112.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 179.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.644 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -166.58 33.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.078 0.466 . . . . 0.0 110.261 179.466 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -120.48 76.36 1.18 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.129 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.518 ' C ' ' HG2' ' A' ' 13' ' ' MET . 30.9 p90 -126.99 151.07 49.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.673 -178.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -133.6 128.43 54.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 178.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.606 ' OH ' HG21 ' A' ' 66' ' ' VAL . 32.5 m-85 -112.74 138.91 48.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.227 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.532 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.7 p90 -162.88 129.64 3.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.235 0.541 . . . . 0.0 110.955 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.572 ' O ' HD23 ' A' ' 78' ' ' LEU . 33.1 t80 -92.36 150.15 21.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 77' ' ' TYR . 90.5 mt -149.21 130.5 14.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.937 0.399 . . . . 0.0 111.104 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.08 -98.47 0.03 OUTLIER Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.916 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -136.14 31.87 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 0.0 110.85 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.466 HG13 ' HA2' ' A' ' 59' ' ' GLY . 60.8 t -148.61 137.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.972 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -97.43 133.96 41.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.022 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.84 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.1 mt -117.78 138.14 49.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.478 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.618 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -133.93 103.41 5.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 0.0 111.368 -179.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.885 HD13 ' HB3' ' A' ' 56' ' ' CYS . 44.8 tp -96.39 108.46 20.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.594 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.49 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.6 p90 -132.81 142.75 49.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.182 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.528 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -123.24 150.99 42.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.627 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.674 ' HA ' HG22 ' A' ' 70' ' ' THR . 82.7 p -93.64 165.36 12.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.525 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HB1' HG13 ' A' ' 22' ' ' VAL . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.784 0.326 . . . . 0.0 111.135 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.4 t -149.7 153.69 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.006 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.714 HD13 ' OE1' ' A' ' 18' ' ' GLN . 59.6 mt -130.42 115.79 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.043 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.03 -30.65 34.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.711 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -159.03 133.37 7.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -116.98 128.57 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.134 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -122.32 -16.01 7.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.523 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 17' ' ' MET . 50.3 tpp -88.53 50.56 1.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.106 0.479 . . . . 0.0 111.822 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.63 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 49.7 m 67.79 -65.25 0.25 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.821 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.696 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 tm-20 166.74 -36.18 0.0 OUTLIER 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.567 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 17' ' ' MET . 2.7 p30 -51.35 -40.78 59.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.805 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.54 ' HB2' ' HG2' ' A' ' 13' ' ' MET . 44.8 ttm -72.24 -18.59 61.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.503 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.714 ' OE1' HD13 ' A' ' 8' ' ' ILE . 71.8 mm-40 -66.51 -48.4 69.91 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -69.8 -38.61 76.68 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.863 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -72.15 -63.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.211 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.15 -44.92 32.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.316 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.642 HG13 ' HB1' ' A' ' 6' ' ' ALA . 55.4 t -60.6 -53.31 50.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.035 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.71 -29.85 71.03 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.694 0.283 . . . . 0.0 110.733 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.1 m -71.78 -31.46 66.63 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -83.44 -24.31 31.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.056 178.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.1 m -80.68 -42.57 21.8 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -75.36 -29.0 59.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.064 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.748 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.85 -47.24 60.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.523 179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.493 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.4 mmt -74.3 -23.61 59.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.763 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -77.37 -51.12 11.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.4 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -81.34 -24.78 36.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.083 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -135.35 168.85 18.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -159.14 44.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.066 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG21 ' OD2' ' A' ' 37' ' ' ASP . 31.5 mt -96.83 -16.68 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.5 mt-10 79.38 -53.07 0.42 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.095 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -79.6 -42.36 25.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.615 0.245 . . . . 0.0 110.863 -179.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.609 ' OD2' HG21 ' A' ' 34' ' ' ILE . 52.6 m-20 -68.86 -17.99 64.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.022 0.439 . . . . 0.0 110.222 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.748 HG23 ' HB1' ' A' ' 28' ' ' ALA . 43.5 mm -72.38 -54.06 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.4 -26.93 63.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.978 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -78.16 -38.11 44.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.61 -24.69 64.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.968 0.413 . . . . 0.0 110.341 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.3 mt -77.84 -53.28 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.755 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 64.7 pttt -66.02 -35.88 81.75 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.657 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 14.0 tppt? -61.66 -47.23 86.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -58.75 -52.47 65.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.265 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.452 ' CE2' ' HG3' ' A' ' 17' ' ' MET . 13.2 m-85 -67.77 -29.44 68.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -70.7 -26.62 63.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.021 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.477 ' NZ ' ' HB3' ' A' ' 48' ' ' LYS . 7.2 ttpm? -89.85 -27.47 19.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -95.55 -50.45 4.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.144 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -91.67 9.3 32.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.371 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 60.69 154.25 0.1 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-O 120.782 0.325 . . . . 0.0 110.901 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 172.12 1.82 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.571 2.181 . . . . 0.0 112.055 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.573 ' O ' HG23 ' A' ' 53' ' ' THR . 9.0 t -121.96 97.11 5.33 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.957 0.503 . . . . 0.0 110.651 -0.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.456 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 13.6 m95 -90.46 172.16 8.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 77.5 t60 -155.06 105.26 2.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.588 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.0 t -75.48 145.96 41.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.164 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 62' ' ' PHE . 35.9 mm -111.89 145.46 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.885 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.752 ' O ' HG13 ' A' ' 58' ' ' VAL . 9.6 p -133.53 63.82 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 121.246 0.546 . . . . 0.0 111.503 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -157.1 -92.47 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.448 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -125.75 -84.85 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.715 0.293 . . . . 0.0 111.088 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.501 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -158.72 15.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.47 -179.811 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 57' ' ' ILE . 9.7 p90 -53.97 -46.13 71.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.826 0.346 . . . . 0.0 111.353 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.47 ' HA3' HG23 ' A' ' 66' ' ' VAL . . . 79.47 -21.28 4.51 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.626 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 26.3 t 70.69 -53.43 0.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.915 0.358 . . . . 0.0 111.123 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -164.88 69.66 0.16 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.124 0.487 . . . . 0.0 111.256 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.612 HG22 ' CD2' ' A' ' 86' ' ' PHE . 42.1 t -91.26 -74.95 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.326 -179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.8 m -43.6 -29.4 0.48 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.522 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 75.4 m-70 -44.97 -26.77 0.46 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 12.2 pt-20 167.43 50.14 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.97 0.414 . . . . 0.0 111.158 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.547 HG21 HG13 ' A' ' 66' ' ' VAL . 35.7 m -102.93 -86.89 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.444 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.1 OUTLIER 72.44 -18.24 0.34 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.333 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.461 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 53.3 m170 -122.23 77.33 1.39 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.738 0.304 . . . . 0.0 110.286 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.438 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 6.4 p90 -125.43 -172.27 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.047 0.451 . . . . 0.0 111.434 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.525 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.5 tt -157.8 129.7 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.259 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.682 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.2 m-30 -106.63 130.78 54.32 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.518 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.475 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.8 p90 -152.73 123.26 7.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.238 0.542 . . . . 0.0 111.411 179.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -93.2 140.7 29.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.721 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.677 HD23 ' N ' ' A' ' 78' ' ' LEU . 1.3 pt? -154.17 138.04 16.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.97 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.89 -100.82 0.59 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.541 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -140.99 23.68 2.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.737 0.303 . . . . 0.0 111.003 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 61.1 t -150.78 150.02 13.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.125 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.76 130.47 44.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.018 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.611 HG23 ' O ' ' A' ' 57' ' ' ILE . 66.0 mt -110.34 137.7 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 85' ' ' LEU . 3.6 tt -129.57 119.6 23.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 111.539 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.645 ' N ' HD23 ' A' ' 84' ' ' LEU . 57.3 tp -109.61 119.75 40.36 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.612 ' CD2' HG22 ' A' ' 66' ' ' VAL . 6.3 p90 -136.87 173.08 12.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.438 0.637 . . . . 0.0 112.45 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.456 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -134.9 84.53 2.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.464 179.024 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 80.0 p -72.22 68.22 0.72 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.463 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.432 -1.204 . . . . 0.0 112.447 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.232 0.16 0 CA-C-O 120.797 0.332 . . . . 0.0 111.318 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.3 t -134.05 147.01 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.04 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 76' ' ' PHE . 25.7 mt -121.64 112.85 36.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' A' ' 9' ' ' LYS . 3.3 mmmp? -66.53 -43.31 85.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.719 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 49.8 t30 -161.39 138.91 8.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.12 94.99 2.94 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.385 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.488 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 33.5 t70 -80.58 -1.74 43.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.653 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.459 ' HE1' ' HB3' ' A' ' 72' ' ' HIS . 47.8 tpp -86.18 165.13 16.78 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' MET . 80.4 p -36.4 -81.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.757 0.313 . . . . 0.0 111.818 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 12.0 pt-20 176.76 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.207 0.527 . . . . 0.0 110.184 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -56.8 -24.6 51.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.582 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.402 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 2.0 mpt? -80.06 -28.29 39.24 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.448 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.77 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.0 mt-30 -65.18 -47.08 78.25 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -77.25 -35.43 55.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.212 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.446 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.4 t70 -71.07 -53.33 15.05 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.265 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.66 -49.86 67.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.0 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 18' ' ' GLN . 80.1 t -54.65 -49.87 64.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.099 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -71.36 -27.31 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.022 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 95.3 m -71.79 -33.49 68.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.75 39.13 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.968 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.5 m -79.17 -45.75 19.29 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.904 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -73.69 -25.28 60.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.279 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.633 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -71.96 -53.26 13.58 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 66.2 mtt -73.48 -20.7 60.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.101 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -78.04 -50.67 11.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.879 0.371 . . . . 0.0 110.741 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -81.99 -23.61 35.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.141 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -131.89 165.91 22.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.85 0.357 . . . . 0.0 111.05 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -156.02 35.88 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.998 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 29.7 mt -98.3 -10.58 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.519 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 78.12 -55.1 0.5 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.105 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.42 -53.04 26.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.676 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.81 -25.39 55.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.633 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -65.63 -55.86 17.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.499 179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.32 -23.39 64.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.985 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.424 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -80.24 -39.0 29.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.851 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.27 -27.16 66.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.406 . . . . 0.0 110.088 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.409 HG21 ' SG ' ' A' ' 56' ' ' CYS . 76.2 mt -80.85 -48.67 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.652 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -67.23 -31.77 72.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.086 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.1 mttt -80.48 -29.43 37.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.1 -39.5 78.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.823 0.344 . . . . 0.0 111.167 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.639 ' CD2' HD21 ' A' ' 85' ' ' LEU . 3.8 m-85 -82.05 -36.09 28.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.257 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.07 -17.63 56.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 21.8 ptmt -85.59 3.79 39.12 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.446 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 48' ' ' LYS . 10.4 mtmp? -142.7 -48.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.926 0.393 . . . . 0.0 110.829 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -87.51 6.26 35.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 60.59 156.07 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-O 120.727 0.299 . . . . 0.0 110.721 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 39.8 Cg_exo -56.65 167.03 3.13 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.394 2.063 . . . . 0.0 112.053 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.0 t -139.08 126.98 22.21 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.241 0.616 . . . . 0.0 110.565 0.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.735 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 1.3 m95 -112.19 -171.28 1.82 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.292 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 50.1 m80 -157.39 58.2 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.281 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.855 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.0 t -48.91 133.52 17.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.673 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.795 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 30.9 mm -106.05 142.21 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.687 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.739 ' O ' HG13 ' A' ' 58' ' ' VAL . 10.9 p -129.73 72.16 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.477 -179.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.66 -92.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.145 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 11.5 mtp-105 -157.59 67.24 0.5 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.653 0.263 . . . . 0.0 110.894 -179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.504 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER 52.15 12.9 0.24 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.394 179.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.795 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.8 p90 -51.67 -25.87 8.05 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.311 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.412 ' N ' ' CD1' ' A' ' 62' ' ' PHE . . . -121.29 48.06 0.98 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.701 179.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.44 ' HA ' HD23 ' A' ' 84' ' ' LEU . 79.9 p -77.6 56.63 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.539 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' A' ' 68' ' ' HIS . 3.1 p90 -98.73 37.7 1.46 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 0.0 110.448 179.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.952 HG22 ' CD2' ' A' ' 86' ' ' PHE . 66.2 t -46.15 -54.26 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.597 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -50.8 -32.54 20.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.052 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.404 ' HB3' ' O ' ' A' ' 65' ' ' TYR . 19.0 t-160 -53.65 -24.01 12.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 88' ' ' SER . 9.5 mp0 -92.78 -77.51 0.44 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.598 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.874 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -176.55 -95.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.845 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.74 ' H ' HG23 ' A' ' 70' ' ' THR . 2.4 mptp? -152.79 22.62 0.59 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.459 ' HB3' ' HE1' ' A' ' 13' ' ' MET . 43.3 m170 -113.12 73.7 0.83 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.987 0.422 . . . . 0.0 110.856 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.528 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 5.8 p90 -113.68 -179.87 3.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.801 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ILE . 7.7 tt 176.39 108.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.998 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 1.1 p90 -113.64 162.57 16.08 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.23 0.538 . . . . 0.0 111.513 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 78' ' ' LEU . 1.3 p90 -153.38 159.05 42.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.111 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.451 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 1.4 t80 -109.78 121.5 45.36 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.96 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.573 HD11 ' HE2' ' A' ' 76' ' ' PHE . 78.7 mt -119.86 112.26 18.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.053 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.41 -90.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.75 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -138.42 31.89 2.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.909 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.6 t -146.55 126.14 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.09 134.9 37.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.27 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.778 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.7 mt -115.43 135.8 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.651 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 64' ' ' SER . 52.1 tp -124.36 107.01 10.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.855 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.8 tp -108.64 130.61 55.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.561 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.952 ' CD2' HG22 ' A' ' 66' ' ' VAL . 2.9 p90 -157.54 151.85 24.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.336 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.735 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -127.92 152.87 47.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.244 0.545 . . . . 0.0 111.774 -179.604 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.874 ' HA ' HG22 ' A' ' 70' ' ' THR . 33.1 t -100.57 77.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.288 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . 0.538 ' O ' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.406 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.876 0.37 . . . . 0.0 111.21 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.552 ' N ' HD22 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.6 mtp . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.799 0.333 . . . . 0.0 111.205 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 79.8 p -59.42 117.2 4.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.963 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -177.66 100.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.084 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.453 ' HD2' ' N ' ' A' ' 4' ' ' ARG . 10.2 mpt_? -103.88 -177.93 3.51 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.59 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -134.39 50.38 2.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.003 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -177.78 115.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.043 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.6 t -155.29 96.37 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.1 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.673 HD13 ' HG2' ' A' ' 18' ' ' GLN . 69.0 mt -79.21 112.43 17.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.948 0.404 . . . . 0.0 110.994 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -80.97 -32.36 34.42 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.933 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -168.45 114.62 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.619 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -112.49 117.96 33.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.452 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -100.87 -13.68 18.27 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.844 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 41.9 tpp -75.32 170.91 15.15 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.377 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.0 t -73.38 38.01 0.09 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.552 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 92.0 mt-10 68.65 -43.91 0.51 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -45.39 -40.22 7.81 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.619 0.247 . . . . 0.0 111.64 -179.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.527 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -71.91 -26.42 62.3 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.818 -0.353 . . . . 0.0 111.16 179.949 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.673 ' HG2' HD13 ' A' ' 8' ' ' ILE . 60.9 mt-30 -64.79 -42.62 94.9 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 177.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -77.09 -40.13 47.14 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.183 178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -70.98 -57.67 4.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.895 0.379 . . . . 0.0 110.907 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.688 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -55.21 -49.83 70.95 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.534 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 18' ' ' GLN . 61.3 t -57.66 -44.82 86.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.352 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -73.96 -30.63 62.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.888 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.41 ' O ' ' CB ' ' A' ' 28' ' ' ALA . 85.7 m -71.97 -32.99 67.8 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB1' HD21 ' A' ' 78' ' ' LEU . . . -80.93 -24.91 37.85 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.252 178.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.406 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 93.4 m -81.25 -43.83 18.63 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.995 0.426 . . . . 0.0 109.925 179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.416 ' HA ' ' HG3' ' A' ' 30' ' ' GLU . 41.5 tt0 -74.87 -26.27 59.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.384 179.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.41 ' CB ' ' O ' ' A' ' 24' ' ' CYS . . . -78.56 -39.39 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.094 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.406 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.4 ptt? -77.21 -26.86 53.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.059 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.49 ' OE2' ' HB2' ' A' ' 31' ' ' LYS . 0.8 OUTLIER -87.01 -37.66 17.3 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.585 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.49 ' HB2' ' OE2' ' A' ' 30' ' ' GLU . 24.3 ttmm -79.21 -28.31 42.55 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.203 178.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -146.73 176.28 9.98 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.803 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 16.1 p-10 -158.04 27.49 0.26 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.173 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 35.6 mm -75.35 -13.03 15.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.549 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 42.9 mt-10 76.56 -54.46 0.58 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.036 -179.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -74.81 -50.15 18.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.94 0.4 . . . . 0.0 110.572 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -56.26 -29.6 61.32 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.15 179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.401 HG23 ' CB ' ' A' ' 28' ' ' ALA . 44.3 mm -62.3 -56.06 20.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.634 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.56 -22.75 56.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.25 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.465 ' O ' ' CB ' ' A' ' 44' ' ' LYS . . . -78.66 -41.49 31.15 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.411 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.78 -26.36 65.17 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.976 0.417 . . . . 0.0 110.427 179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.1 mt -80.32 -48.27 20.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.942 179.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.432 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 2.7 pptp? -69.69 -32.67 71.42 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.764 179.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 51.9 tttp -68.24 -44.98 74.48 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.939 179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -61.73 -43.4 98.92 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.1 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.16 -16.71 52.12 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.615 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -87.0 -43.02 12.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.795 0.331 . . . . 0.0 111.115 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -90.26 21.77 3.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.649 -179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -138.0 -42.87 0.52 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.659 0.266 . . . . 0.0 111.226 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -111.29 10.6 21.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.664 -179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 62.5 142.72 0.06 OUTLIER Pre-proline 0 CA--C 1.529 0.165 0 CA-C-O 120.638 0.256 . . . . 0.0 110.898 179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -50.0 173.91 0.05 OUTLIER 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.339 2.026 . . . . 0.0 112.358 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -125.15 112.28 16.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 123.015 0.526 . . . . 0.0 110.611 -0.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.549 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 7.1 m95 -102.32 -167.29 1.38 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.802 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -176.14 90.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.45 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.767 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -89.19 144.32 26.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.491 -179.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.608 ' O ' HG23 ' A' ' 83' ' ' ILE . 9.2 mm -115.15 150.94 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.66 179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.515 ' HA ' HG12 ' A' ' 83' ' ' ILE . 47.7 t -137.42 91.66 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.267 179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 177.77 -83.55 0.07 OUTLIER Glycine 0 N--CA 1.45 -0.414 0 CA-C-N 115.783 -0.644 . . . . 0.0 112.218 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.53 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 64.0 mtm-85 -140.97 -75.86 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.897 0.38 . . . . 0.0 111.137 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.545 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -161.07 23.1 0.13 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.895 -179.645 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.498 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.7 p90 -71.91 2.47 5.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -177.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -57.81 -58.6 13.72 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.489 -0.862 . . . . 0.0 112.377 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m 44.69 54.01 6.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.911 0.386 . . . . 0.0 111.08 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.477 ' CG ' ' O ' ' A' ' 65' ' ' TYR . 37.8 t80 -165.77 31.6 0.05 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.745 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.662 HG13 ' HB3' ' A' ' 73' ' ' PHE . 59.7 t -84.6 -72.77 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.396 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.6 m -69.64 -26.07 64.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.996 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 37.9 m80 -46.62 -25.29 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.847 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.526 ' HB2' ' CB ' ' A' ' 88' ' ' SER . 17.1 pt-20 -103.88 -63.6 1.18 Allowed 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.949 -0.3 . . . . 0.0 111.709 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.817 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.6 t -150.94 -116.71 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.607 -0.146 . . . . 0.0 110.607 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.475 ' HD2' ' C ' ' A' ' 70' ' ' THR . 7.5 mptt -154.29 30.61 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.685 0.278 . . . . 0.0 110.954 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.409 ' HD2' HG21 ' A' ' 70' ' ' THR . 90.3 m-70 -105.94 68.05 0.77 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.871 0.367 . . . . 0.0 110.894 -179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.662 ' HB3' HG13 ' A' ' 66' ' ' VAL . 5.6 p90 -117.74 175.5 5.62 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.176 0.512 . . . . 0.0 111.434 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.557 HG23 ' O ' ' A' ' 74' ' ' ILE . 9.4 tt -160.4 110.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.359 178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.46 ' CE2' ' CE1' ' A' ' 73' ' ' PHE . 66.4 m-85 -91.4 140.04 30.14 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.921 -179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.688 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 24.8 p90 -161.14 121.0 2.65 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 121.328 0.585 . . . . 0.0 110.079 178.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.463 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 31.6 t80 -92.6 139.22 30.8 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.949 -177.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.684 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -111.5 162.98 14.53 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.89 178.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.434 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -51.79 100.14 0.05 OUTLIER Glycine 0 CA--C 1.521 0.418 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.423 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.46 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 71.85 25.09 3.21 Favored 'General case' 0 CA--C 1.516 -0.345 0 CA-C-O 121.149 0.499 . . . . 0.0 110.685 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.484 HG12 ' N ' ' A' ' 82' ' ' ALA . 95.9 t -155.54 158.82 3.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.924 179.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.53 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -132.42 143.12 49.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.704 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.641 ' HB ' ' CE1' ' A' ' 76' ' ' PHE . 54.0 mt -140.16 137.78 37.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.724 0.297 . . . . 0.0 110.68 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.667 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -138.12 115.67 11.28 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.011 0.434 . . . . 0.0 111.657 -179.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.767 HD13 ' HB2' ' A' ' 56' ' ' CYS . 56.1 tp -102.18 130.73 48.91 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.629 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.475 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.3 p90 -151.67 157.71 42.46 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.317 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.549 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -146.62 162.67 37.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.942 -179.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.817 ' HA ' HG22 ' A' ' 70' ' ' THR . 93.4 p -94.07 167.8 11.35 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.054 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.528 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.786 0.327 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.3 t -159.52 125.08 4.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.848 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 67.0 t0 -93.36 48.16 1.3 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.954 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.611 ' HE ' HG21 ' A' ' 7' ' ' VAL . 68.1 mtp180 78.36 108.79 0.07 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.29 0.567 . . . . 0.0 110.386 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 6' ' ' ALA . 86.5 tttt -121.86 27.68 7.99 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.169 -179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 5' ' ' LYS . . . 169.22 103.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.254 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.611 HG21 ' HE ' ' A' ' 4' ' ' ARG . 57.8 t -148.79 107.98 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.088 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.759 HD13 ' OE1' ' A' ' 18' ' ' GLN . 68.4 mt -86.05 115.85 28.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.899 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.472 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 0.7 OUTLIER -84.84 -31.08 24.0 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.621 179.642 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -171.9 112.08 0.3 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.526 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.723 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -132.06 105.94 7.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.036 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.426 ' OD1' ' CD1' ' A' ' 73' ' ' PHE . 12.6 p-10 -77.63 -4.41 45.84 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.245 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.503 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.3 tpp -75.02 165.77 24.73 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.121 -0.325 . . . . 0.0 110.121 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.434 ' O ' ' CG ' ' A' ' 15' ' ' GLU . 79.8 p -50.54 -95.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.669 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 47.4 mt-10 -162.99 -36.93 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.55 0.691 . . . . 0.0 110.194 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -56.53 -27.64 57.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.722 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.503 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.9 mpt? -77.67 -25.35 49.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.441 179.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.759 ' OE1' HD13 ' A' ' 8' ' ' ILE . 41.2 mm-40 -65.51 -50.12 66.46 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 177.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -77.48 -32.47 54.36 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 114.853 -1.067 . . . . 0.0 111.688 179.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.1 t0 -73.64 -50.4 21.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.858 0.361 . . . . 0.0 110.602 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.634 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -59.82 -47.77 84.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.315 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.75 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -58.76 -51.61 69.98 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.134 0 C-N-CA 121.04 -0.264 . . . . 0.0 111.066 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -70.21 -28.39 65.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.556 0.217 . . . . 0.0 110.854 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.418 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 24.7 t -71.48 -32.34 68.16 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -81.01 -25.55 37.12 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.115 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.1 m -79.55 -45.11 19.85 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.119 0.485 . . . . 0.0 109.811 179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.51 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.5 mt-30 -73.12 -26.34 61.19 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.324 179.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.67 -39.96 50.49 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.075 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -73.1 -32.33 64.89 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.196 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.51 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 12.4 pt-20 -80.58 -45.28 17.61 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.104 0.478 . . . . 0.0 109.758 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.402 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 57.0 tptt -71.52 -20.82 61.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.673 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 54.4 m-85 -142.49 133.14 25.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 120.903 0.382 . . . . 0.0 111.088 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -102.72 29.94 5.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.492 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.512 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.8 mt -115.11 168.79 6.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.512 ' H ' HG22 ' A' ' 34' ' ' ILE . 16.7 pt-20 -113.24 18.87 17.55 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.524 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -125.97 -44.39 1.78 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.732 0.301 . . . . 0.0 110.223 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 55.3 p30 -68.2 -17.09 64.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.444 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 40.1 mm -69.63 -51.76 38.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.399 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.78 -22.16 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.108 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.66 -38.89 25.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.87 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' A' ' 45' ' ' GLU . 6.5 t80 -70.54 -26.31 63.51 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.19 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.418 HG21 ' CB ' ' A' ' 56' ' ' CYS . 78.6 mt -84.01 -43.85 17.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 62.8 tttp -67.26 -35.6 79.86 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.64 178.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 26.6 tptp -68.86 -59.89 2.76 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.387 -179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' A' ' 41' ' ' TYR . 5.4 mm-40 -49.57 -51.72 35.03 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.89 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.66 ' CD2' HD21 ' A' ' 85' ' ' LEU . 14.6 m-85 -67.75 -31.23 71.0 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.395 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 6.3 t70 -73.58 -26.27 60.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 0.0 110.794 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -90.05 -24.77 21.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.98 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -95.76 -57.91 2.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.202 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 47.8 m-85 -94.69 17.05 14.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.319 -179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 58.98 161.17 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.945 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -68.33 170.2 15.29 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.602 2.201 . . . . 0.0 111.922 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 92.0 m -124.5 104.73 8.89 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 123.282 0.633 . . . . 0.0 110.572 -0.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.453 ' HZ3' ' HE3' ' A' ' 13' ' ' MET . 7.3 m95 -99.9 -171.11 1.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.59 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 77.9 t60 -179.98 85.23 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.955 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.832 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.8 t -66.65 153.28 43.55 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.861 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.899 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.6 mm -118.16 138.73 47.9 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.655 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.282 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.615 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.6 p -119.48 62.39 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 114.812 -1.085 . . . . 0.0 111.46 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -165.68 -92.73 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.483 -0.865 . . . . 0.0 112.597 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.826 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 79.0 mtt-85 -144.94 -65.25 0.34 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.823 0.344 . . . . 0.0 111.349 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.521 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.87 19.3 0.32 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.843 -179.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.673 ' CE1' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -67.49 5.16 0.84 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -136.14 57.82 0.67 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.933 -0.651 . . . . 0.0 111.878 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.9 m -69.08 55.47 0.1 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.027 0.441 . . . . 0.0 111.662 -179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.46 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 4.7 m-85 -99.22 35.11 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.55 179.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 66' ' ' VAL . 44.2 t -98.48 -1.34 10.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.791 -179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 86.9 m -115.55 -27.7 7.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.814 0.34 . . . . 0.0 111.043 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.554 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 36.1 m80 -50.12 -26.43 4.49 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.242 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.554 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 22.6 pt-20 156.66 45.49 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 120.889 0.376 . . . . 0.0 110.975 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 88' ' ' SER . 20.0 m -94.04 -84.05 0.32 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.481 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.508 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 74.84 -12.41 0.94 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.536 -179.32 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.443 ' H ' HG22 ' A' ' 70' ' ' THR . 9.0 t-160 -139.02 82.87 1.92 Allowed 'General case' 0 CA--C 1.529 0.143 0 N-CA-C 110.124 -0.325 . . . . 0.0 110.124 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.527 ' HD1' ' N ' ' A' ' 74' ' ' ILE . 7.7 p90 -110.51 -172.3 2.0 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.085 0.469 . . . . 0.0 111.753 -178.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.723 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.5 tt -160.93 113.16 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.211 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.749 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 8.1 m-30 -100.94 153.72 19.28 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.839 0.352 . . . . 0.0 111.484 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.634 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 20.6 p90 -170.27 137.49 1.5 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.721 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.458 ' O ' HD23 ' A' ' 78' ' ' LEU . 1.3 t80 -93.67 134.24 36.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.158 -178.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.897 HD12 HD12 ' A' ' 83' ' ' ILE . 81.4 mt -131.72 125.44 32.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.625 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.84 -110.94 1.42 Allowed Glycine 0 C--N 1.331 0.268 0 C-N-CA 120.551 -0.833 . . . . 0.0 112.086 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.579 ' HA ' ' NE2' ' A' ' 80' ' ' GLN . 5.0 mm100 -128.61 49.65 2.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.346 0.593 . . . . 0.0 110.603 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.433 HG23 ' C ' ' A' ' 80' ' ' GLN . 91.7 t -160.2 138.61 2.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.638 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.826 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -83.91 134.06 34.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.272 179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.899 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.3 mt -135.69 133.41 51.54 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.339 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.724 HD13 ' N ' ' A' ' 84' ' ' LEU . 0.0 OUTLIER -148.87 143.89 26.55 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 119.743 -0.783 . . . . 0.0 112.474 -179.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.832 HD13 ' HB2' ' A' ' 56' ' ' CYS . 61.1 tp -116.81 155.99 28.02 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.271 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.464 ' H ' HD12 ' A' ' 85' ' ' LEU . 10.9 p90 -164.3 158.68 19.04 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.031 0.443 . . . . 0.0 111.977 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.44 ' HB2' ' CH2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -108.25 76.95 1.07 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.705 -0.679 . . . . 0.0 109.737 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 81.2 p -74.91 73.97 2.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.529 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.407 -1.219 . . . . 0.0 112.56 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.51 ' HA ' ' CE ' ' A' ' 1' ' ' MET . 10.4 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.862 0.363 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t 60.04 31.67 20.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 62.29 90.26 0.08 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.946 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -124.88 42.68 3.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.672 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 22.1 pttp -113.9 50.01 0.95 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.847 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 67.27 108.86 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.21 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.552 ' N ' HD22 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.885 0.374 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t -139.58 161.32 37.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.875 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.7 t0 60.41 76.72 0.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.693 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 50.3 mtp85 -103.07 -41.09 6.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.825 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 24.2 pttm 44.02 48.72 7.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.402 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.414 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . -177.98 100.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.814 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.443 HG12 ' N ' ' A' ' 8' ' ' ILE . 45.1 t -147.9 155.17 10.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.992 0.425 . . . . 0.0 111.635 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.817 HD11 ' HB3' ' A' ' 18' ' ' GLN . 77.6 mt -130.11 123.19 55.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.668 179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -87.14 -31.93 20.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.442 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -178.99 110.92 0.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.607 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.776 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -156.1 144.95 20.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.191 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.486 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.3 t70 -143.47 18.22 1.87 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.61 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.499 ' CG ' ' HG3' ' A' ' 17' ' ' MET . 50.3 tpp -69.5 65.65 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.69 -179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.414 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 47.1 t 56.97 12.7 1.27 Allowed 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 47.6 mt-10 69.35 -49.77 0.61 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 179.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -46.31 -36.16 6.02 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.646 -179.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.624 ' HB2' HD12 ' A' ' 74' ' ' ILE . 21.8 mmt -75.84 -24.41 55.81 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.769 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.817 ' HB3' HD11 ' A' ' 8' ' ' ILE . 64.9 mt-30 -67.02 -41.7 86.16 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 66.5 tp60 -82.53 -34.54 27.86 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.021 179.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.499 ' O ' ' OD1' ' A' ' 23' ' ' ASP . 7.8 t0 -74.81 -37.76 62.25 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.154 0.502 . . . . 0.0 110.527 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.465 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -71.01 -45.66 63.56 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.708 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.801 HG23 ' O ' ' A' ' 18' ' ' GLN . 73.9 t -59.43 -55.11 25.92 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.266 179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.499 ' OD1' ' O ' ' A' ' 20' ' ' ASP . 57.7 p30 -67.25 -25.23 65.98 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.057 -0.257 . . . . 0.0 110.987 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 54.1 t -72.46 -36.53 68.53 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 178.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -75.12 -26.33 59.14 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.645 178.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.9 m -76.65 -53.97 7.3 Favored 'General case' 0 CA--C 1.522 -0.123 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.745 179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.419 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -63.4 -24.57 67.9 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.451 178.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.02 58.42 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.64 179.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.6 ptp -75.75 -24.6 56.1 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.131 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -79.35 -51.01 9.98 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.976 0.417 . . . . 0.0 110.075 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -72.16 -27.12 62.39 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.575 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -135.3 146.79 48.85 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.753 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -134.44 42.57 2.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.027 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.5 mt -101.43 -13.31 8.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.555 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.9 mt-10 76.85 -54.51 0.57 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.212 -179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -71.98 -56.03 6.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.485 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.465 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.07 -25.49 31.35 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.249 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.1 mm -60.61 -49.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.38 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.736 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -65.15 -22.58 66.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.161 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.55 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.74 -40.42 22.74 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.79 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.403 ' O ' ' CD1' ' A' ' 41' ' ' TYR . 5.4 t80 -68.36 -28.35 67.05 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.33 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.452 HD11 ' HA ' ' A' ' 25' ' ' ALA . 96.5 mt -77.36 -49.92 21.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.985 179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.538 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.6 ptmt -65.34 -36.26 83.47 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 178.175 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.55 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.7 tptm -55.24 -55.55 30.06 Favored 'General case' 0 N--CA 1.456 -0.16 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.65 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -56.06 -54.97 38.61 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.839 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.444 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.8 m-85 -63.54 -20.05 65.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.263 179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -74.44 -56.31 4.99 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.656 0.265 . . . . 0.0 111.255 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HE2' ' CE ' ' A' ' 44' ' ' LYS . 68.1 mttm -87.0 7.81 26.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.757 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -114.37 -29.89 6.75 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.813 0.34 . . . . 0.0 111.025 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CZ ' ' CE ' ' A' ' 17' ' ' MET . 48.6 m-85 -130.37 6.55 4.87 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.42 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.53 150.63 0.1 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-O 120.636 0.255 . . . . 0.0 111.049 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -56.92 172.55 0.74 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.526 2.151 . . . . 0.0 112.081 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -121.97 126.4 48.49 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.105 0.562 . . . . 0.0 110.709 -0.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.482 ' CZ2' ' HG2' ' A' ' 87' ' ' LYS . 3.6 m95 -122.29 172.17 8.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.758 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.412 ' HB3' ' OH ' ' A' ' 65' ' ' TYR . 37.9 m80 -149.74 81.62 1.39 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.327 179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.662 ' HB3' HD13 ' A' ' 85' ' ' LEU . 31.2 p -72.9 138.38 46.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.416 -179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.799 ' O ' HG23 ' A' ' 83' ' ' ILE . 29.2 mm -109.04 147.15 13.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.379 179.274 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.736 HG21 ' HB2' ' A' ' 39' ' ' ALA . 52.9 t -129.44 74.27 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.767 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.713 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 178.94 -100.16 0.14 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.383 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -126.68 -77.1 0.58 Allowed 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 120.881 0.372 . . . . 0.0 110.882 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.529 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.53 19.44 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.091 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.656 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 8.1 p90 -58.62 -15.53 12.0 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -134.62 54.26 0.76 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.46 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.446 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 41.0 t -60.88 -95.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 111.607 0.225 . . . . 0.0 111.607 -179.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.412 ' OH ' ' HB3' ' A' ' 55' ' ' HIS . 36.9 p90 41.71 37.87 0.83 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.763 0.316 . . . . 0.0 111.476 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.977 HG22 ' CE1' ' A' ' 86' ' ' PHE . 47.6 t -60.07 -39.04 79.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.085 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 90.1 m -68.94 -29.13 67.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.788 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.9 t60 -49.79 -26.09 3.62 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.013 0.435 . . . . 0.0 110.27 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 8.8 mp0 -82.01 -77.25 0.23 Allowed 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.416 179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.825 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.2 t -172.42 -86.63 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.272 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.825 ' H ' HG23 ' A' ' 70' ' ' THR . 1.5 tptm -166.95 29.92 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.214 0.53 . . . . 0.0 109.841 179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.422 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 93.4 m-70 -129.29 81.27 2.01 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.618 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.509 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 5.9 p90 -112.7 179.06 4.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.929 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.776 HG13 ' HB1' ' A' ' 11' ' ' ALA . 8.0 tt -162.29 111.25 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.457 178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.904 ' OH ' HG21 ' A' ' 66' ' ' VAL . 7.0 m-30 -100.61 151.03 22.1 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.838 0.351 . . . . 0.0 110.787 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.465 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 1.7 p90 -168.18 116.4 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.967 0.413 . . . . 0.0 110.802 178.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.657 ' O ' HD23 ' A' ' 78' ' ' LEU . 4.3 t80 -84.7 141.14 30.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.89 -179.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.657 HD23 ' O ' ' A' ' 77' ' ' TYR . 80.0 mt -139.05 135.8 34.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.087 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.18 -93.15 0.01 OUTLIER Glycine 0 C--N 1.33 0.231 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.761 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.907 ' OE1' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -139.93 20.9 2.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.688 0.28 . . . . 0.0 111.608 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.907 HG23 ' OE1' ' A' ' 80' ' ' GLN . 92.3 t -140.26 129.95 28.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.87 0.367 . . . . 0.0 110.862 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.413 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -89.08 128.53 35.75 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.818 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.799 HG23 ' O ' ' A' ' 57' ' ' ILE . 59.7 mt -104.11 135.87 39.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.844 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.578 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 10.2 mp -122.42 107.45 12.07 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.609 -179.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 56' ' ' CYS . 65.4 tp -110.01 120.35 42.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.872 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.977 ' CE1' HG22 ' A' ' 66' ' ' VAL . 1.5 m-85 -111.1 165.14 12.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.868 0.366 . . . . 0.0 111.055 -179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.482 ' HG2' ' CZ2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -136.44 117.72 14.58 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.659 -179.858 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.805 ' HA ' HG22 ' A' ' 70' ' ' THR . 46.1 t -98.41 151.81 20.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.913 179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.537 179.923 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 mmt . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.805 0.336 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 t -89.65 111.75 22.8 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.987 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -161.93 30.62 0.12 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.924 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.449 ' NE ' ' HA ' ' A' ' 4' ' ' ARG . 5.0 mmp_? -107.08 -73.73 0.68 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.85 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.5 mttt 58.24 91.39 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.799 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.412 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 62.25 98.46 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.023 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.508 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 55.4 t -143.83 138.83 25.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.096 -179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.878 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.1 mp -103.97 136.44 37.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.206 -179.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.521 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 61.7 mttp -94.28 29.0 2.32 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.577 178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.715 ' H ' HG22 ' A' ' 8' ' ' ILE . 45.1 t30 87.68 106.68 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.328 -179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.467 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -126.88 179.05 5.58 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.05 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -168.6 19.22 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.541 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 44.8 ttp -80.35 62.88 4.63 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.206 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 45.6 m 72.55 1.57 4.03 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.442 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 46.7 mt-10 70.5 -51.18 0.66 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.999 0.428 . . . . 0.0 111.783 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -48.26 -29.25 3.64 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.945 0.402 . . . . 0.0 110.326 179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.485 ' HG2' ' HE3' ' A' ' 13' ' ' MET . 1.0 OUTLIER -72.72 -29.86 63.71 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.622 179.464 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.872 ' HA ' HD11 ' A' ' 74' ' ' ILE . 65.6 mt-30 -65.29 -38.33 89.89 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -73.63 -44.43 57.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.082 -0.963 . . . . 0.0 111.39 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.71 -54.33 9.28 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.858 0.361 . . . . 0.0 111.258 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.516 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -55.35 -52.1 64.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.425 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.537 HG23 ' O ' ' A' ' 18' ' ' GLN . 78.1 t -57.6 -50.56 76.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.036 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.431 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 1.3 m-20 -69.79 -24.75 63.54 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.989 -0.285 . . . . 0.0 110.787 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.9 t -71.75 -38.05 70.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -76.62 -23.02 53.38 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.779 178.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.402 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 89.3 m -78.92 -50.88 10.47 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.526 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 23.9 pt20 -69.74 -23.92 63.46 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.373 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.431 ' C ' HD12 ' A' ' 38' ' ' ILE . . . -76.88 -43.49 35.74 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.062 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.402 ' CE ' ' HA ' ' A' ' 26' ' ' THR . 27.1 ptt? -73.03 -27.43 61.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.739 -179.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.3 pt-20 -84.25 -43.95 14.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.049 0.452 . . . . 0.0 109.932 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.405 ' N ' ' HG3' ' A' ' 30' ' ' GLU . 99.1 mttt -74.2 -21.02 59.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.973 179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.503 ' HB2' HD11 ' A' ' 38' ' ' ILE . 2.3 m-85 -131.28 -172.24 2.79 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 120.701 0.286 . . . . 0.0 110.808 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -173.97 35.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.807 0.337 . . . . 0.0 111.122 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.692 HD12 ' OD2' ' A' ' 37' ' ' ASP . 31.2 mt -99.41 -18.07 6.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 67.45 11.86 8.6 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.305 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -129.07 -54.44 1.2 Allowed 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.692 ' OD2' HD12 ' A' ' 34' ' ' ILE . 26.7 m-20 -58.7 -23.03 58.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 178.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' A' ' 32' ' ' TYR . 44.3 mm -61.37 -58.55 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.359 179.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.654 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -62.55 -21.21 65.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.937 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.453 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -81.81 -41.57 20.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.985 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -70.15 -22.82 62.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.809 0.338 . . . . 0.0 110.582 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 96.9 mt -82.31 -48.45 18.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 23.5 pttm -70.47 -33.75 71.62 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.842 179.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 59.1 mtpt -72.49 -38.42 68.16 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -61.71 -40.81 96.34 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.915 0.388 . . . . 0.0 110.431 179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.736 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.5 m-85 -81.51 -36.73 28.87 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.396 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 56.4 m-20 -75.03 -26.62 59.62 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.664 0.269 . . . . 0.0 111.369 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -90.24 29.52 1.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.813 0.339 . . . . 0.0 111.212 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -155.0 -44.36 0.08 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.678 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -106.94 -4.89 18.62 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.461 -179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.449 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 74.0 m-80 63.53 162.33 0.12 Allowed Pre-proline 0 C--N 1.331 -0.221 0 CA-C-O 120.647 0.261 . . . . 0.0 111.122 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.541 ' HB3' HG22 ' A' ' 53' ' ' THR . 79.6 Cg_exo -46.32 173.49 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.826 2.351 . . . . 0.0 112.38 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.541 HG22 ' HB3' ' A' ' 52' ' ' PRO . 66.7 p -119.24 115.08 23.46 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.232 0.613 . . . . 0.0 110.629 -0.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.66 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 1.1 m95 -114.62 -174.13 2.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.136 0.493 . . . . 0.0 110.932 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.427 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 58.5 m-70 -163.45 61.8 0.17 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.202 178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.664 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -53.52 137.88 35.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.402 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.814 ' O ' HG23 ' A' ' 83' ' ' ILE . 28.8 mm -115.59 149.84 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.343 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.654 HG21 ' HB2' ' A' ' 39' ' ' ALA . 47.7 t -141.34 53.83 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 121.132 0.491 . . . . 0.0 110.89 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -155.06 -67.3 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.447 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.72 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.961 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -177.23 -48.8 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.681 0.276 . . . . 0.0 111.351 179.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.516 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -172.5 18.54 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.669 ' CE1' HG23 ' A' ' 57' ' ' ILE . 39.4 p90 -59.89 -33.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.431 -177.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -71.76 -58.21 5.45 Favored Glycine 0 C--N 1.33 0.247 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.337 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.422 ' O ' ' CD1' ' A' ' 65' ' ' TYR . 81.2 p 51.41 75.31 0.21 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.422 ' CD1' ' O ' ' A' ' 64' ' ' SER . 23.1 m-85 -143.1 29.72 1.46 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.214 179.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.623 HG21 ' OH ' ' A' ' 75' ' ' TYR . 47.7 t -58.73 -62.08 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.701 -179.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.405 ' HA ' ' OG1' ' A' ' 70' ' ' THR . 86.6 m -55.52 -31.7 62.3 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.83 0.347 . . . . 0.0 110.949 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.458 ' O ' ' CD2' ' A' ' 68' ' ' HIS . 18.7 t-160 -77.13 -5.52 49.35 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.066 178.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.514 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 89.3 mt-10 -160.47 50.58 0.28 Allowed 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.921 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.442 ' N ' ' O ' ' A' ' 66' ' ' VAL . 98.9 m -86.48 -9.05 57.02 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.579 ' HA ' ' HE2' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -45.28 -24.66 0.3 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.718 0.294 . . . . 0.0 111.744 -179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 71' ' ' LYS . 4.3 m170 -171.91 99.92 0.17 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.109 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.541 ' O ' ' HB2' ' A' ' 13' ' ' MET . 2.1 p90 -113.97 166.55 11.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.155 0.502 . . . . 0.0 111.761 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.872 HD11 ' HA ' ' A' ' 18' ' ' GLN . 8.2 tt -158.79 123.71 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.001 179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.878 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.8 m-30 -111.18 139.31 46.67 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.516 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.8 p90 -170.47 132.37 0.98 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.025 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.606 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 2.5 p90 -126.43 154.31 43.83 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.095 0.474 . . . . 0.0 111.737 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' A' ' 6' ' ' ALA . 81.5 mt -115.58 103.13 10.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.519 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.26 -86.67 0.4 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.485 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.479 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.1 OUTLIER -124.63 -11.79 7.24 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.7 t -95.59 120.15 44.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.718 0.294 . . . . 0.0 110.778 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.961 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -98.48 129.0 45.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.06 0.457 . . . . 0.0 111.758 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.814 HG23 ' O ' ' A' ' 57' ' ' ILE . 69.3 mt -109.34 131.39 60.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.014 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.81 HD12 ' C ' ' A' ' 83' ' ' ILE . 6.4 mp -127.88 107.79 10.15 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.646 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.736 HD21 ' CD2' ' A' ' 46' ' ' PHE . 67.0 tp -106.91 133.81 51.01 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.405 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.516 ' HB3' ' HA ' ' A' ' 73' ' ' PHE . 10.6 p90 -169.72 157.09 6.76 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.087 -178.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.66 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -144.99 157.67 44.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.281 0.563 . . . . 0.0 111.795 179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.514 ' HB2' ' HG2' ' A' ' 69' ' ' GLU . 41.9 t -87.61 179.49 6.52 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.2 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.332 -1.26 . . . . 0.0 112.451 179.692 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.4 mtp . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.81 0.338 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.3 t -146.84 -175.96 5.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.783 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -163.92 71.86 0.24 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -103.18 -37.83 7.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.633 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -90.92 46.57 1.33 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.811 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.403 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . -177.44 93.33 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.027 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.488 ' HB ' ' CZ ' ' A' ' 77' ' ' TYR . 43.7 t -131.72 149.18 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.134 -179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.831 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.8 mp -108.0 138.05 36.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.106 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.499 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 27.5 mtpp -96.92 29.4 3.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.11 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.649 ' H ' HG22 ' A' ' 8' ' ' ILE . 0.7 OUTLIER 88.97 85.97 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.576 -179.96 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.555 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -98.81 165.75 11.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.184 -179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.478 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.1 t70 -148.93 21.57 0.99 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.531 179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.555 ' O ' ' HG2' ' A' ' 13' ' ' MET . 47.3 ttm -94.54 42.27 1.09 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.84 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 16' ' ' ASP . 50.0 m 68.19 111.94 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.853 0.359 . . . . 0.0 110.321 -179.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.438 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 8.6 mp0 -33.69 -34.62 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.194 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' A' ' 14' ' ' SER . 7.5 t70 -55.82 -45.22 78.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.768 0.318 . . . . 0.0 110.863 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.552 ' HE1' ' CZ ' ' A' ' 50' ' ' TYR . 23.4 mmt -69.96 -22.14 63.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.757 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.826 ' HA ' HD11 ' A' ' 74' ' ' ILE . 0.7 OUTLIER -68.78 -39.57 80.14 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.62 -38.61 54.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.823 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -72.8 -54.41 8.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.008 0.433 . . . . 0.0 110.535 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.23 -49.86 70.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.284 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 18' ' ' GLN . 77.8 t -57.86 -54.66 28.77 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.199 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.549 ' O ' HG22 ' A' ' 26' ' ' THR . 63.2 m-20 -66.78 -26.13 66.81 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.805 0.336 . . . . 0.0 110.746 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 49.3 t -73.05 -29.09 62.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.417 ' CB ' HD11 ' A' ' 78' ' ' LEU . . . -77.67 -31.83 52.79 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.346 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 23' ' ' ASP . 3.9 t -78.48 -48.73 14.75 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.155 -0.684 . . . . 0.0 109.155 179.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' N ' ' CG2' ' A' ' 26' ' ' THR . 11.6 mm100 -64.42 -25.6 68.09 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.125 178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -74.96 -44.63 47.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.977 179.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.599 ' HE3' ' HG3' ' A' ' 30' ' ' GLU . 0.0 OUTLIER -75.91 -24.07 55.56 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.22 -179.786 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.599 ' HG3' ' HE3' ' A' ' 29' ' ' MET . 96.5 mt-10 -77.51 -55.84 5.04 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.984 0.421 . . . . 0.0 110.021 178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -64.81 -25.17 67.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.762 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -141.18 135.05 30.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.673 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -102.28 26.1 8.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.319 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 35' ' ' GLU . 5.6 mm -98.55 177.14 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.665 ' H ' HG22 ' A' ' 34' ' ' ILE . 56.2 mt-10 -115.22 0.22 13.46 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.662 0.268 . . . . 0.0 110.935 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.478 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 8.0 mtpm? -111.27 -47.69 3.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.272 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -59.71 -26.21 65.43 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.417 ' CG1' ' O ' ' A' ' 34' ' ' ILE . 39.8 mm -63.85 -58.97 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.341 179.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.84 -19.84 64.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.0 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.419 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -78.9 -43.12 25.55 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.045 179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -68.98 -28.26 66.45 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.003 0.43 . . . . 0.0 110.015 179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 74.4 mt -82.59 -46.59 19.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.485 178.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -67.88 -30.77 70.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.169 179.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 45.3 mmtm -79.03 -40.26 31.84 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.928 0.394 . . . . 0.0 110.78 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -58.5 -42.38 87.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.031 -179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -82.0 -45.43 15.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.763 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -68.18 -25.67 65.36 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.469 ' NZ ' ' HB2' ' A' ' 48' ' ' LYS . 4.7 ttmp? -71.06 -21.27 62.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.669 -0.241 . . . . 0.0 111.615 -179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -125.13 -4.44 7.42 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.552 ' CZ ' ' HE1' ' A' ' 17' ' ' MET . 2.8 m-85 -130.19 4.98 4.84 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 59.89 156.78 0.1 Allowed Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.629 0.252 . . . . 0.0 111.146 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.431 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.7 Cg_endo -60.49 174.66 1.46 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.545 2.163 . . . . 0.0 112.089 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.431 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 9.0 t -122.26 125.21 45.54 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.132 0.573 . . . . 0.0 110.884 0.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CE3' ' HB2' ' A' ' 87' ' ' LYS . 4.0 m95 -117.27 -171.61 2.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.197 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.509 ' CD2' HD11 ' A' ' 57' ' ' ILE . 73.4 t60 -174.31 72.64 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.998 0.427 . . . . 0.0 110.878 179.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.844 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -59.43 128.85 39.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.836 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.823 ' O ' HG23 ' A' ' 83' ' ' ILE . 33.3 mm -98.5 147.22 7.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.446 ' O ' HG12 ' A' ' 58' ' ' VAL . 49.1 t -127.98 65.16 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.821 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.794 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.11 -97.15 0.11 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -123.6 -83.75 0.65 Allowed 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 120.656 0.265 . . . . 0.0 110.922 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.476 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -152.34 10.96 0.52 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.818 -179.727 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.605 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 23.2 p90 -49.24 -24.1 1.63 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -177.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -120.85 44.64 1.33 Allowed Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.456 -0.878 . . . . 0.0 113.068 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 51.6 m -93.59 62.13 3.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.893 0.378 . . . . 0.0 110.762 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 1.5 p90 -109.75 29.79 7.27 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.164 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.549 HG11 ' N ' ' A' ' 87' ' ' LYS . 47.6 t -118.37 -22.59 4.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.549 -179.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.9 m -48.45 -27.69 2.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.876 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.3 t-80 -45.7 -28.25 0.98 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.466 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.5 mm-40 -108.55 -67.51 0.97 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.219 179.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.466 ' HB ' ' O ' ' A' ' 69' ' ' GLU . 11.4 m 80.47 0.6 1.92 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.901 179.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.506 ' HG3' ' CE1' ' A' ' 72' ' ' HIS . 21.9 tptm -47.1 -28.52 1.79 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.196 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.506 ' CE1' ' HG3' ' A' ' 71' ' ' LYS . 67.0 m80 -157.05 93.94 1.38 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.395 179.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.568 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -120.98 152.28 38.74 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.235 -179.383 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.826 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -152.42 120.5 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.217 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.831 ' O ' HG23 ' A' ' 8' ' ' ILE . 13.6 m-85 -107.68 139.26 42.5 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.921 0.391 . . . . 0.0 111.376 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 1.5 p90 -170.28 122.22 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.489 178.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.567 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 4.8 p90 -104.99 144.7 31.44 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 121.062 0.458 . . . . 0.0 111.526 -179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.417 HD11 ' CB ' ' A' ' 25' ' ' ALA . 71.3 mt -111.98 110.98 21.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.422 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -76.58 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.422 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.435 HE21 HG23 ' A' ' 81' ' ' VAL . 3.1 pm0 -149.02 25.7 0.91 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.796 0.331 . . . . 0.0 111.035 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.794 HG13 ' HA2' ' A' ' 59' ' ' GLY . 53.3 t -133.26 100.87 3.85 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.031 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.567 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -69.76 127.27 32.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.607 -179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.823 HG23 ' O ' ' A' ' 57' ' ' ILE . 62.5 mt -104.04 138.53 28.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.553 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.598 HD12 ' O ' ' A' ' 83' ' ' ILE . 11.0 mp -128.09 103.66 7.34 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.188 -0.46 . . . . 0.0 112.019 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.844 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.1 tp -108.31 113.31 26.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.517 ' CB ' HG11 ' A' ' 66' ' ' VAL . 9.0 m-85 -127.14 -179.19 4.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.953 0.406 . . . . 0.0 111.565 -178.459 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.549 ' N ' HG11 ' A' ' 66' ' ' VAL . 1.5 tmtp? -151.87 98.47 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.069 179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.494 ' N ' HG13 ' A' ' 66' ' ' VAL . 48.0 t -73.17 81.05 1.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.829 0.347 . . . . 0.0 110.838 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.431 -1.205 . . . . 0.0 112.463 -179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 120.918 0.39 . . . . 0.0 111.106 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.1 t -103.67 -175.82 2.91 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.008 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -158.26 82.7 0.84 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.902 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -147.8 176.46 10.11 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.927 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 tttp -149.24 57.29 1.01 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.129 0.49 . . . . 0.0 110.643 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -179.97 103.69 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.581 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.566 HG12 ' N ' ' A' ' 8' ' ' ILE . 26.6 t -153.76 163.91 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.243 -179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.623 HD13 ' HG3' ' A' ' 18' ' ' GLN . 58.8 mt -114.69 115.31 49.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.343 179.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -70.07 -41.26 74.36 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.272 -179.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.66 74.41 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.868 0.366 . . . . 0.0 110.679 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -79.18 142.63 36.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.176 -179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.482 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 8.8 t70 -146.78 23.55 1.23 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.68 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.498 ' HE2' ' O ' ' A' ' 72' ' ' HIS . 27.4 ttm -107.9 47.58 0.89 Allowed 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 120.738 -0.385 . . . . 0.0 111.076 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.479 ' HB3' ' O ' ' A' ' 13' ' ' MET . 33.2 t 74.37 114.82 0.06 Allowed 'General case' 0 CA--C 1.52 -0.192 0 CA-C-O 120.935 0.398 . . . . 0.0 110.617 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 16.6 pt-20 -32.56 -35.67 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.666 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.4 ' N ' ' O ' ' A' ' 14' ' ' SER . 65.9 t0 -54.55 -37.57 65.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.858 0.361 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.443 ' HB3' HD12 ' A' ' 74' ' ' ILE . 1.0 OUTLIER -74.71 -19.82 60.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.923 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -70.76 -45.06 65.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.826 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 23.4 pt20 -78.75 -32.95 46.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.582 178.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.436 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.9 t70 -72.09 -46.62 56.05 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.431 ' CB ' ' O ' ' A' ' 17' ' ' MET . . . -61.08 -41.61 96.96 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.636 179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.923 HG23 ' O ' ' A' ' 18' ' ' GLN . 76.6 t -57.69 -58.46 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.091 0 CA-C-O 120.716 0.293 . . . . 0.0 110.587 179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' O ' ' OE1' ' A' ' 27' ' ' GLN . 55.9 m-20 -66.13 -30.39 70.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.187 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.686 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -68.67 -33.9 74.78 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.92 -25.38 37.51 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.678 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.6 m -74.86 -49.86 19.02 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.782 179.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.405 ' OE1' ' O ' ' A' ' 23' ' ' ASP . 9.1 mp0 -73.53 -24.38 60.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.459 178.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.613 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -68.84 -45.73 70.38 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.905 0.383 . . . . 0.0 110.255 179.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.558 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.0 mmt -79.53 -19.7 48.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.784 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -79.3 -46.45 17.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.542 179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -81.07 -18.28 47.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.316 179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -149.84 167.09 27.55 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.811 0.339 . . . . 0.0 111.35 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.9 m-80 -156.54 45.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.993 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.524 HG21 ' OD1' ' A' ' 37' ' ' ASP . 30.2 mt -99.65 -7.06 9.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.391 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.462 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.9 mt-10 76.44 -56.07 0.57 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.954 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.488 ' NZ ' ' HB3' ' A' ' 36' ' ' LYS . 7.9 mtpm? -76.76 -53.66 7.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.578 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.524 ' OD1' HG21 ' A' ' 34' ' ' ILE . 1.5 m-20 -55.6 -26.81 45.88 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.223 179.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.613 HG23 ' HB1' ' A' ' 28' ' ' ALA . 48.3 mm -61.27 -52.32 62.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.279 179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.11 -26.59 62.8 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.047 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.598 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -77.45 -42.91 34.24 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.96 179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.429 ' CE1' ' OE2' ' A' ' 45' ' ' GLU . 5.1 t80 -68.88 -31.14 69.86 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.069 179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.686 HG23 ' SG ' ' A' ' 24' ' ' CYS . 97.2 mt -76.62 -50.65 21.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.744 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 17.9 ptpt -63.63 -35.19 79.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 178.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.514 ' C ' ' HD3' ' A' ' 44' ' ' LYS . 0.9 OUTLIER -56.41 -52.57 64.14 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.623 179.271 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.429 ' OE2' ' CE1' ' A' ' 41' ' ' TYR . 94.3 mt-10 -58.15 -48.68 79.52 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.675 0.274 . . . . 0.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.559 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -64.97 -21.13 66.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.617 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 41.8 m-20 -80.33 -34.36 36.75 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.742 0.306 . . . . 0.0 111.098 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.687 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 7.7 mmpt? -90.13 13.95 13.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.541 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 6.7 ttpm? -119.43 -6.75 10.26 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.484 0.183 . . . . 0.0 111.329 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.452 ' CE2' ' HE2' ' A' ' 49' ' ' LYS . 51.2 m-85 -148.61 -79.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.833 0.349 . . . . 0.0 111.07 179.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -177.98 135.77 0.35 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.716 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.31 169.27 22.02 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.425 2.083 . . . . 0.0 112.445 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.9 m -114.32 127.85 56.06 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 122.982 0.513 . . . . 0.0 110.844 0.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.455 ' CD1' ' OD1' ' A' ' 47' ' ' ASP . 7.9 m95 -89.02 176.06 7.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.053 179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.435 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 73.8 t60 -155.4 103.97 2.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.952 0.406 . . . . 0.0 110.841 179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.774 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.1 t -93.83 147.37 23.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.066 -179.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.501 HG23 ' CE1' ' A' ' 62' ' ' PHE . 6.9 mm -117.46 162.41 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.66 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.408 ' N ' HG22 ' A' ' 57' ' ' ILE . 59.1 t -147.19 87.51 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.052 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 173.66 -87.5 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.488 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.488 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 77.9 mtt-85 -157.99 66.54 0.47 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.659 0.266 . . . . 0.0 110.946 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.465 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER 49.46 15.67 0.14 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.252 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.501 ' CE1' HG23 ' A' ' 57' ' ' ILE . 6.3 p90 -59.68 -19.03 46.9 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.521 -178.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -54.4 -51.26 52.67 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.903 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 65.1 m 49.34 70.18 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.877 0.37 . . . . 0.0 110.583 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.488 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 1.6 t80 -149.65 50.59 0.93 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.149 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.541 ' O ' HG12 ' A' ' 66' ' ' VAL . 39.4 t -119.67 -0.88 8.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.222 -0.444 . . . . 0.0 112.069 -178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -107.21 -29.05 9.56 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.715 0.293 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.516 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 93.2 m-70 -49.09 -27.47 3.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.816 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 14.4 pt-20 153.52 49.06 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 O-C-N 123.59 0.556 . . . . 0.0 110.9 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' A' ' 71' ' ' LYS . 44.8 m -103.1 -86.79 0.43 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.317 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.52 ' HD2' ' N ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER 75.35 -13.86 0.82 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.65 -179.501 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.498 ' O ' ' HE2' ' A' ' 13' ' ' MET . 53.3 m170 -123.29 81.17 1.86 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 5.7 p90 -114.29 170.95 7.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.716 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.526 HG13 ' HB1' ' A' ' 11' ' ' ALA . 7.5 tt -147.18 108.42 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.579 178.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.6 ' CD1' HD13 ' A' ' 84' ' ' LEU . 7.6 m-30 -76.64 149.87 36.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.487 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.581 ' HB3' ' HB ' ' A' ' 83' ' ' ILE . 3.2 t80 -150.53 135.42 17.55 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.217 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 81' ' ' VAL . 51.9 t80 -125.89 127.76 46.52 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-O 120.757 0.313 . . . . 0.0 111.459 -179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.651 HD12 ' N ' ' A' ' 78' ' ' LEU . 0.7 OUTLIER -126.57 109.79 12.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.795 179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 56.41 -88.1 0.01 OUTLIER Glycine 0 CA--C 1.517 0.217 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.768 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.508 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -129.61 21.42 5.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.723 0.297 . . . . 0.0 111.021 -179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.52 HG12 ' N ' ' A' ' 82' ' ' ALA . 53.8 t -128.16 160.76 37.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.737 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.52 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -130.11 115.04 16.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.785 0.326 . . . . 0.0 111.303 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.581 ' HB ' ' HB3' ' A' ' 76' ' ' PHE . 68.5 mt -95.16 125.01 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 178.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.6 HD13 ' CD1' ' A' ' 75' ' ' TYR . 52.0 tp -119.87 107.28 12.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.704 -178.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.774 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.6 tp -106.87 150.44 26.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.262 -0.426 . . . . 0.0 109.941 178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.488 ' CE2' ' O ' ' A' ' 65' ' ' TYR . 17.9 p90 -174.62 178.27 1.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.07 0.462 . . . . 0.0 111.508 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.462 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 5.8 tmtm? -132.76 88.87 2.56 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.336 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 43.3 t -73.15 69.24 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.581 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.407 -1.218 . . . . 0.0 112.59 179.948 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.2 ttm . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.784 0.326 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t -90.89 142.11 28.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.878 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -103.03 31.59 4.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.892 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 36.8 mmt180 -117.73 -168.65 1.54 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.859 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -133.98 57.99 1.79 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.92 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' HB1' HG11 ' A' ' 22' ' ' VAL . . . -171.11 84.06 0.09 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.27 -179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.7 t -130.79 135.34 60.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.839 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.766 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.9 mp -104.19 96.93 4.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.864 0.364 . . . . 0.0 111.147 -179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 27.6 mtpp -60.99 -18.58 58.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.482 179.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 43.7 t30 172.66 135.97 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.994 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.512 ' HB3' ' CD ' ' A' ' 18' ' ' GLN . . . -156.5 138.59 14.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.008 0.433 . . . . 0.0 111.664 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.455 ' HB3' ' CE1' ' A' ' 73' ' ' PHE . 38.5 t70 -133.91 12.21 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.768 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.627 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 47.8 ttm -90.7 34.34 0.9 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.22 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.47 ' O ' ' N ' ' A' ' 16' ' ' ASP . 38.6 t 68.4 112.02 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.51 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.4 mt-10 -27.58 -39.08 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.352 -0.84 . . . . 0.0 112.563 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 14' ' ' SER . 1.5 m-20 -51.32 -45.64 62.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.355 -179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.494 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.6 mpt? -70.76 -23.24 62.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.144 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.932 ' HA ' HD11 ' A' ' 74' ' ' ILE . 63.0 mt-30 -70.8 -37.87 73.31 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -80.52 -34.57 35.49 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.68 178.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -74.93 -50.88 15.31 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.071 0.462 . . . . 0.0 110.404 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.37 -52.5 65.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.195 179.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.606 HG23 ' O ' ' A' ' 18' ' ' GLN . 96.5 t -58.65 -47.67 88.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 CA-C-O 120.614 0.245 . . . . 0.0 110.981 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 36.5 t70 -66.63 -35.19 79.58 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.628 179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.0 t -68.12 -35.2 77.75 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 178.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -77.62 -24.9 49.46 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.725 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -75.97 -52.89 9.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.875 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 23.5 pt20 -66.95 -26.15 66.69 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.969 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -65.67 -56.44 12.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.508 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 22.3 ptp -69.28 -18.6 63.86 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.794 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -82.47 -47.82 11.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.245 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -72.86 -27.96 62.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.675 179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.47 ' CD2' ' OD2' ' A' ' 37' ' ' ASP . 13.1 m-85 -119.24 -170.88 2.01 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.453 179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.4 ' ND2' ' O ' ' A' ' 33' ' ' ASN . 0.8 OUTLIER -147.67 27.94 0.97 Allowed 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.795 -179.458 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.562 HG22 ' H ' ' A' ' 35' ' ' GLU . 7.1 mt -121.21 170.7 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.562 ' H ' HG22 ' A' ' 34' ' ' ILE . 24.5 pt-20 -114.48 23.79 12.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.779 0.323 . . . . 0.0 110.977 -179.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -124.68 -49.05 1.77 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.578 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.514 ' OD1' ' HB ' ' A' ' 34' ' ' ILE . 9.4 p-10 -64.09 -27.37 69.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 178.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.537 ' O ' HD13 ' A' ' 42' ' ' ILE . 34.3 mm -61.35 -57.04 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.649 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.62 -28.83 61.32 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.28 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.451 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -76.96 -35.14 57.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.906 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.418 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 50.8 t80 -69.38 -30.35 68.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.78 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.537 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.1 mp -84.28 -43.51 17.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 25.9 ttpp -66.29 -31.95 73.06 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.939 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 73.2 mmtt -83.45 -39.45 20.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.92 179.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 17.5 tp10 -54.04 -47.29 71.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.961 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.499 ' CD2' HD21 ' A' ' 85' ' ' LEU . 56.1 m-85 -80.05 -44.41 20.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.221 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 39.0 t70 -67.0 -9.81 42.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.75 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 44' ' ' LYS . 4.1 tppp? -81.65 -27.62 34.01 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -149.97 41.44 0.83 Allowed 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.425 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 9.1 m-85 -132.78 -86.63 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.567 0.223 . . . . 0.0 111.022 179.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 179.59 104.78 0.16 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.515 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 31.3 Cg_exo -57.46 160.28 14.32 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.195 1.93 . . . . 0.0 111.996 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.8 m -112.38 142.52 44.82 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 123.303 0.641 . . . . 0.0 110.621 -0.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.475 ' HB3' HD11 ' A' ' 85' ' ' LEU . 19.5 m95 -111.08 138.2 47.79 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.839 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 52.8 m170 -122.03 98.15 5.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.065 179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.552 ' HB2' HD13 ' A' ' 85' ' ' LEU . 54.0 t -82.04 142.32 32.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.568 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.853 ' O ' HG23 ' A' ' 83' ' ' ILE . 16.5 mm -117.75 142.92 29.85 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.428 0 CA-C-O 120.842 0.354 . . . . 0.0 111.773 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.737 ' O ' HG13 ' A' ' 58' ' ' VAL . 12.3 p -127.71 94.57 2.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.394 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.495 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 168.19 -94.43 0.11 Allowed Glycine 0 C--N 1.33 0.245 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.947 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -125.22 -85.84 0.63 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.574 0.225 . . . . 0.0 111.604 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.545 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -146.41 13.81 1.24 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.525 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 21.2 p90 -70.94 52.03 0.15 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.778 0.323 . . . . 0.0 111.054 -177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.647 ' HA3' HD11 ' A' ' 84' ' ' LEU . . . -78.69 -62.0 2.33 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.356 -0.926 . . . . 0.0 113.419 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.565 ' O ' ' CG ' ' A' ' 65' ' ' TYR . 21.3 m 79.58 116.58 0.06 Allowed 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 -178.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.565 ' CG ' ' O ' ' A' ' 64' ' ' SER . 36.1 p90 53.39 64.26 1.92 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.738 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 86' ' ' PHE . 51.8 t -94.4 -24.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.626 -179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.559 HG22 ' HD2' ' A' ' 71' ' ' LYS . 87.2 m -134.82 -32.63 0.97 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.671 0.272 . . . . 0.0 111.555 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 77.8 t60 -67.72 -5.93 18.41 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.53 ' HG2' ' N ' ' A' ' 70' ' ' THR . 13.8 pm0 -91.01 -50.86 5.63 Favored 'General case' 0 C--N 1.333 -0.147 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.555 ' O ' ' CB ' ' A' ' 71' ' ' LYS . 4.5 t -134.4 -44.67 0.76 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.559 ' HD2' HG22 ' A' ' 67' ' ' THR . 14.2 mmmm 108.69 32.83 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.709 0 O-C-N 124.394 1.059 . . . . 0.0 110.017 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.499 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 94.3 m-70 -128.54 79.21 1.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.581 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.627 ' O ' ' HB2' ' A' ' 13' ' ' MET . 11.0 p90 -118.7 171.64 8.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.526 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.932 HD11 ' HA ' ' A' ' 18' ' ' GLN . 12.4 tt -168.07 111.0 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.094 178.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.565 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.7 m-85 -97.22 154.58 17.3 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.035 0.445 . . . . 0.0 111.576 179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.51 ' CE1' ' HB ' ' A' ' 83' ' ' ILE . 15.0 p90 -170.37 123.67 0.69 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.724 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -88.18 125.77 34.79 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.592 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.545 HD21 HG13 ' A' ' 22' ' ' VAL . 86.6 mt -123.17 132.87 54.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.218 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.99 -100.0 0.06 OUTLIER Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.792 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.527 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.49 23.84 4.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.712 0.291 . . . . 0.0 111.014 -179.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.495 HG13 ' HA2' ' A' ' 59' ' ' GLY . 46.9 t -140.64 137.24 35.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -90.9 128.66 36.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.077 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.853 HG23 ' O ' ' A' ' 57' ' ' ILE . 73.6 mt -118.85 137.44 52.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.516 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.647 HD11 ' HA3' ' A' ' 63' ' ' GLY . 0.7 OUTLIER -135.09 113.66 11.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.103 0.478 . . . . 0.0 111.47 179.622 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' ' 56' ' ' CYS . 45.8 tp -98.99 141.05 32.24 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.67 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.725 ' HB3' HG13 ' A' ' 66' ' ' VAL . 8.0 p90 -156.44 139.86 15.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.448 0.642 . . . . 0.0 111.616 -179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.567 ' HD3' ' N ' ' A' ' 88' ' ' SER . 1.6 tmtp? -94.32 154.2 17.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.435 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.567 ' N ' ' HD3' ' A' ' 87' ' ' LYS . 8.6 m -127.95 148.44 50.51 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.845 0.355 . . . . 0.0 110.771 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.409 -1.217 . . . . 0.0 112.489 179.988 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.875 0.369 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.4 m -98.8 109.58 22.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.9 52.54 2.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -152.76 146.33 25.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.953 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -168.63 30.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 61.69 132.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.36 179.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.563 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.5 ttp . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.815 0.34 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.7 t 61.74 152.51 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.783 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -176.74 82.22 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.856 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.528 ' CG ' HG22 ' A' ' 7' ' ' VAL . 21.5 tpp180 -105.3 -18.63 14.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.144 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.488 ' N ' ' HD3' ' A' ' 5' ' ' LYS . 3.3 mppt? 63.67 86.31 0.12 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.979 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 66.37 124.2 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.229 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.528 HG22 ' CG ' ' A' ' 4' ' ' ARG . 42.8 t -144.46 81.38 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.138 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.594 HG21 ' HB2' ' A' ' 11' ' ' ALA . 61.1 mt -60.75 116.76 2.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.969 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -71.95 -44.39 63.66 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.634 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 43.9 t30 -153.71 116.98 4.58 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.902 0.382 . . . . 0.0 110.941 179.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.594 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -103.73 84.0 2.21 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.224 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.463 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 59.5 t0 -81.1 -5.21 57.4 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.971 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.459 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 47.7 tpp -92.99 162.64 13.97 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.58 0.229 . . . . 0.0 110.444 179.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 13' ' ' MET . 62.9 m -40.07 -74.56 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.968 -179.542 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 39.6 tt0 177.71 -31.62 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.527 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.515 ' HB2' ' HE1' ' A' ' 17' ' ' MET . 59.8 m-20 -56.85 -33.08 66.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.099 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.516 ' HB3' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -75.59 -26.77 58.15 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.672 179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.794 ' O ' HG23 ' A' ' 22' ' ' VAL . 62.8 mt-30 -66.33 -46.07 78.09 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -79.92 -32.55 40.14 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.94 178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.503 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.4 t0 -72.67 -50.06 27.43 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 110.051 -0.352 . . . . 0.0 110.051 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB1' ' CE1' ' A' ' 76' ' ' PHE . . . -58.82 -48.83 79.94 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.081 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 18' ' ' GLN . 90.9 t -55.23 -53.12 38.3 Favored 'Isoleucine or valine' 0 C--O 1.231 0.122 0 C-N-CA 120.856 -0.338 . . . . 0.0 110.917 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -71.84 -24.5 61.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.834 0.35 . . . . 0.0 110.653 179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 20' ' ' ASP . 39.1 t -72.87 -32.8 65.65 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.07 -27.55 39.3 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.894 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.7 m -78.2 -45.83 22.03 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.721 -0.474 . . . . 0.0 109.721 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' HA ' ' HG2' ' A' ' 30' ' ' GLU . 26.8 mt-30 -71.98 -24.92 61.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.355 179.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.827 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -76.0 -41.78 50.1 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.177 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 87.7 mtp -74.93 -29.82 61.07 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.688 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.544 ' HG2' ' HA ' ' A' ' 27' ' ' GLN . 16.4 pt-20 -82.38 -43.04 17.88 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.982 0.42 . . . . 0.0 110.135 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.4 ' O ' ' CD1' ' A' ' 32' ' ' TYR . 62.8 tttp -76.31 -21.35 56.32 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.743 179.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.425 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 54.7 m-85 -152.51 161.1 43.05 Favored 'General case' 0 N--CA 1.461 0.099 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.979 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -144.5 18.57 1.69 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.61 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.46 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 27.6 mm -75.77 -13.78 15.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.772 -0.194 . . . . 0.0 111.379 -179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 87.2 mt-10 74.94 -54.02 0.67 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.823 0.344 . . . . 0.0 110.772 -179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.406 ' NZ ' HG22 ' A' ' 34' ' ' ILE . 33.3 mtmm -69.75 -57.96 4.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.51 179.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -52.86 -27.22 17.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.305 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.827 HG23 ' HB1' ' A' ' 28' ' ' ALA . 49.3 mm -61.31 -54.22 38.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.438 179.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.14 -27.12 63.48 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.129 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.528 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -80.73 -38.78 28.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.762 179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -70.42 -27.6 64.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.358 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.44 HG12 ' SG ' ' A' ' 24' ' ' CYS . 86.9 mt -79.55 -47.69 21.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.562 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -65.29 -38.45 90.26 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 22.4 tptm -57.02 -57.29 13.2 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.126 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -55.13 -51.24 67.06 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.225 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.49 ' CE2' HD22 ' A' ' 85' ' ' LEU . 39.8 m-85 -62.67 -25.38 68.11 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.713 0.292 . . . . 0.0 111.115 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -86.45 -25.99 24.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.158 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -89.9 -17.53 27.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.429 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -101.84 -61.14 1.42 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.701 0.286 . . . . 0.0 111.353 -179.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -91.71 14.7 14.53 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.627 -179.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 75.1 m-20 59.79 157.14 0.1 Allowed Pre-proline 0 C--N 1.332 -0.177 0 CA-C-O 120.679 0.276 . . . . 0.0 110.94 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.405 ' HD2' ' HB3' ' A' ' 51' ' ' ASN . 15.2 Cg_endo -57.3 172.63 0.86 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.533 2.155 . . . . 0.0 112.066 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 53' ' ' THR . 9.5 t -122.82 103.41 8.62 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.077 0.551 . . . . 0.0 110.819 0.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.682 ' HB3' HD11 ' A' ' 85' ' ' LEU . 4.5 m95 -102.12 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.486 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 78.1 t60 178.17 75.98 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.238 179.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.623 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.2 t -64.21 148.25 50.51 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.396 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.817 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.5 mm -114.68 146.18 19.48 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.604 179.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -133.23 77.22 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.769 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.524 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 177.76 -81.2 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.521 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 55.9 mtp85 -142.72 -80.69 0.21 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.748 0.309 . . . . 0.0 111.288 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.488 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -156.3 14.43 0.31 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.761 -179.618 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.76 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.5 p90 -51.66 -25.67 7.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.817 0.341 . . . . 0.0 111.263 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.34 51.96 0.84 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 121.023 -0.608 . . . . 0.0 111.728 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.0 p -85.78 60.48 6.27 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.057 0.456 . . . . 0.0 111.178 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.43 ' HB2' ' CZ ' ' A' ' 86' ' ' PHE . 13.8 m-85 -89.47 30.7 0.98 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.685 179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.585 HG13 ' HB3' ' A' ' 73' ' ' PHE . 66.3 t -46.84 -77.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.9 m -53.08 -30.55 36.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.522 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 79.4 t60 -56.78 -20.98 25.22 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.866 0.365 . . . . 0.0 110.258 179.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.618 ' HG3' ' HB2' ' A' ' 88' ' ' SER . 0.3 OUTLIER -82.39 -73.62 0.39 Allowed 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.357 179.531 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.843 HG23 ' H ' ' A' ' 71' ' ' LYS . 1.5 t -175.61 -86.64 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.406 179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.843 ' H ' HG23 ' A' ' 70' ' ' THR . 13.9 tptt -163.47 26.15 0.08 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.992 0.425 . . . . 0.0 110.373 179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -122.88 75.3 1.27 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.403 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.585 ' HB3' HG13 ' A' ' 66' ' ' VAL . 9.3 p90 -119.23 -176.25 3.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.192 0.52 . . . . 0.0 111.858 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.516 HG21 ' HB3' ' A' ' 17' ' ' MET . 7.9 tt 177.68 111.72 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.421 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.634 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 9.3 p90 -123.99 147.93 47.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.289 0.566 . . . . 0.0 111.986 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.6 ' HE2' HD11 ' A' ' 78' ' ' LEU . 2.0 p90 -140.37 170.14 16.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.846 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.4 ' O ' HD23 ' A' ' 78' ' ' LEU . 3.1 t80 -121.21 137.72 54.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.726 -179.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.6 HD11 ' HE2' ' A' ' 76' ' ' PHE . 84.3 mt -131.36 130.88 43.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.116 -179.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.7 -92.09 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.806 179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.664 ' NE2' HG23 ' A' ' 81' ' ' VAL . 2.0 pp0? -138.46 33.82 2.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.996 0.426 . . . . 0.0 110.94 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.664 HG23 ' NE2' ' A' ' 80' ' ' GLN . 87.8 t -138.38 150.59 24.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.556 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -110.92 118.68 36.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.123 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.817 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.5 mp -105.07 132.97 50.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.331 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -137.61 124.51 21.3 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.104 0.478 . . . . 0.0 111.487 -179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.682 HD11 ' HB3' ' A' ' 54' ' ' TRP . 33.2 tp -119.74 137.47 53.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.876 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.574 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 2.8 p90 -137.68 152.65 49.51 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.181 0.515 . . . . 0.0 111.965 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.537 ' C ' ' HD3' ' A' ' 87' ' ' LYS . 6.4 tmtm? -124.94 127.93 47.82 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.155 -178.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.802 ' HA ' HG22 ' A' ' 70' ' ' THR . 29.0 t -96.22 151.3 19.63 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.623 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.375 -1.236 . . . . 0.0 112.554 179.791 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 120.889 0.376 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 78.8 p -179.17 -175.23 0.36 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.808 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -173.47 82.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.791 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -152.31 -179.31 7.43 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.934 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.501 ' HD2' ' N ' ' A' ' 5' ' ' LYS . 0.6 OUTLIER -98.08 33.13 2.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.879 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.439 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . -171.62 93.92 0.16 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.682 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 44.3 t -134.04 105.34 6.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.43 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.702 HD13 ' HG3' ' A' ' 18' ' ' GLN . 67.6 mt -82.58 113.94 22.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.955 0.407 . . . . 0.0 110.585 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -78.8 -34.3 45.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.955 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -169.88 110.73 0.43 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.509 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -125.3 137.32 54.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.974 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -140.88 2.03 1.72 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.51 ' O ' ' HG2' ' A' ' 13' ' ' MET . 50.2 ttp -94.19 58.87 2.56 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 120.314 -0.555 . . . . 0.0 111.781 -179.817 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.9 t 64.18 111.85 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 121.02 0.438 . . . . 0.0 111.283 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.538 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -35.08 -34.51 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.853 179.615 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -50.9 -39.19 53.76 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.853 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.414 ' HG2' ' CE ' ' A' ' 13' ' ' MET . 0.9 OUTLIER -68.77 -25.31 64.65 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.245 179.825 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.702 ' HG3' HD13 ' A' ' 8' ' ' ILE . 2.8 mp0 -68.57 -42.91 77.62 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -79.05 -32.07 44.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.393 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -77.11 -50.19 13.59 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-O 120.896 0.379 . . . . 0.0 110.636 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.78 80.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.874 179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 18' ' ' GLN . 98.8 t -63.07 -41.05 91.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.726 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -68.11 -39.68 82.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.96 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 81.1 m -67.71 -32.78 73.66 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -78.29 -25.55 46.69 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.469 177.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 99.0 m -74.97 -55.24 5.97 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.746 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -65.36 -26.63 68.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.212 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.523 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -67.54 -46.55 72.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.613 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.52 ' HA ' ' CE ' ' A' ' 29' ' ' MET . 1.6 tpt -70.06 -27.02 64.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.749 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -83.31 -43.22 16.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.027 0.442 . . . . 0.0 110.125 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -77.86 -22.54 49.7 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.919 179.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.4 m-85 -133.79 150.05 51.43 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.741 0.305 . . . . 0.0 110.978 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -116.37 29.83 7.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.022 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.711 HG22 ' H ' ' A' ' 35' ' ' GLU . 4.9 mt -123.55 176.35 5.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.711 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.2 mt-10 -109.18 14.73 23.7 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.775 0.321 . . . . 0.0 110.786 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.551 ' HA ' ' NZ ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -113.99 -58.9 2.09 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.288 179.981 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -53.52 -25.76 18.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.903 179.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.523 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 40.4 mm -64.0 -59.94 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.465 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.457 ' HB2' ' HB ' ' A' ' 58' ' ' VAL . . . -58.05 -29.91 65.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.97 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.524 ' HA ' ' HG2' ' A' ' 43' ' ' LYS . . . -71.69 -42.78 67.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.376 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.432 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 5.5 t80 -66.78 -27.8 67.88 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.92 0.391 . . . . 0.0 110.256 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 75.6 mt -79.06 -50.39 18.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.184 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.524 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 21.2 pttm -71.23 -27.78 63.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.407 179.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.454 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 55.9 mtpt -71.26 -48.12 52.96 Favored 'General case' 0 C--O 1.23 0.065 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.648 179.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -61.39 -37.56 83.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.734 0.302 . . . . 0.0 110.818 179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.586 ' CD2' HD21 ' A' ' 85' ' ' LEU . 4.7 m-85 -83.29 -19.54 36.09 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.755 179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -88.4 -36.72 16.39 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.72 0.295 . . . . 0.0 111.395 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.467 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 4.0 mptp? -90.27 29.21 1.28 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.363 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -145.86 -44.37 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.834 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -104.79 5.79 33.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.45 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.1 m120 61.61 154.0 0.11 Allowed Pre-proline 0 C--N 1.333 -0.141 0 CA-C-O 120.766 0.317 . . . . 0.0 110.886 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 50.9 Cg_exo -54.01 174.77 0.14 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.579 2.186 . . . . 0.0 112.173 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 87.9 m -126.84 97.22 4.9 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 123.118 0.567 . . . . 0.0 110.455 -0.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.632 ' HB2' ' O ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -150.9 -179.08 6.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.889 -179.733 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.646 ' O ' HD12 ' A' ' 85' ' ' LEU . 19.8 p-80 -179.51 -179.63 0.54 Allowed 'General case' 0 CA--C 1.521 -0.147 0 CA-C-O 120.935 0.397 . . . . 0.0 111.043 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 85' ' ' LEU . 31.9 p -116.91 153.33 32.76 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.357 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.688 ' O ' HG23 ' A' ' 83' ' ' ILE . 19.4 mm -94.38 147.63 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.294 179.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.712 ' O ' HG13 ' A' ' 58' ' ' VAL . 11.4 p -122.19 72.06 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.534 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.77 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -177.52 -78.39 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.622 -0.799 . . . . 0.0 112.376 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -149.79 -82.09 0.11 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.7 0.286 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.486 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 13.02 0.35 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.775 -179.933 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.615 ' CE1' HG23 ' A' ' 57' ' ' ILE . 4.1 p90 -55.97 -20.29 15.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -129.14 50.04 0.9 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.567 -0.825 . . . . 0.0 112.732 -179.564 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 70.5 m -50.11 -87.36 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 O-C-N 122.79 -0.241 . . . . 0.0 111.222 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 8.8 m-30 58.38 61.46 2.27 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.004 0.431 . . . . 0.0 110.72 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 66' ' ' VAL . 43.8 t -116.64 -0.45 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.838 -179.629 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -111.37 -28.1 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.777 0.322 . . . . 0.0 111.172 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.586 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 90.4 m-70 -48.37 -27.73 2.76 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.178 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.586 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 16.6 pt-20 155.22 45.85 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 122.819 0.447 . . . . 0.0 110.735 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.57 HG21 HG13 ' A' ' 66' ' ' VAL . 22.9 m -92.31 -85.96 0.25 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.516 -179.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 70' ' ' THR . 31.1 mmmt 76.12 -12.32 1.03 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.074 -179.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.492 ' H ' HG22 ' A' ' 70' ' ' THR . 19.9 m80 -132.89 81.45 1.94 Allowed 'General case' 0 C--O 1.23 0.076 0 CA-C-O 120.962 0.411 . . . . 0.0 110.25 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 13' ' ' MET . 17.7 p90 -115.47 -177.08 3.06 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.651 -179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.627 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.0 tt -168.55 123.24 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.05 179.036 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.906 ' CD1' HD23 ' A' ' 84' ' ' LEU . 61.4 m-85 -101.76 137.27 40.28 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.217 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.448 ' CZ ' ' CG2' ' A' ' 83' ' ' ILE . 1.3 p90 -159.03 117.54 2.92 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.085 0.469 . . . . 0.0 111.281 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.448 ' O ' HD23 ' A' ' 78' ' ' LEU . 48.8 t80 -84.53 136.78 33.67 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.924 -179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.548 HD12 HD12 ' A' ' 83' ' ' ILE . 90.0 mt -136.58 123.68 21.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.922 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 54.05 -106.61 0.5 Allowed Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.541 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.444 ' OE1' HG23 ' A' ' 81' ' ' VAL . 1.6 pp0? -125.46 33.72 5.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 111.352 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.77 HG13 ' HA2' ' A' ' 59' ' ' GLY . 89.0 t -155.46 124.84 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.601 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -88.64 131.61 34.91 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.9 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.688 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.6 mt -110.02 138.72 36.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.532 179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.906 HD23 ' CD1' ' A' ' 75' ' ' TYR . 2.8 tm? -135.75 115.59 13.06 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.927 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.646 HD12 ' O ' ' A' ' 55' ' ' HIS . 56.0 tp -96.91 136.84 36.9 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.605 178.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.632 ' O ' ' HB2' ' A' ' 54' ' ' TRP . 23.6 p90 -142.3 123.64 14.77 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 120.457 -0.497 . . . . 0.0 111.675 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 54' ' ' TRP . 1.6 tmtp? -84.96 69.3 10.78 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.554 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 47.6 t -76.75 63.66 2.2 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.698 -179.619 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.539 179.992 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.3 mtp . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 120.706 0.288 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.2 m -150.0 42.89 0.87 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.925 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -85.4 57.64 4.57 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.709 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 51.0 mmt-85 -123.61 -168.77 1.83 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.742 ' O ' HD22 ' A' ' 78' ' ' LEU . 40.2 ttmt -174.69 55.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.512 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.443 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . -177.52 83.76 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.975 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.529 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 57.9 t -123.68 134.37 66.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.113 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.806 HG23 ' O ' ' A' ' 75' ' ' TYR . 2.0 mp -112.35 101.05 11.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.177 -179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.477 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 33.3 mmtp -54.74 -23.14 16.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.87 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 45.1 t30 177.44 119.58 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.691 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.596 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -94.94 95.62 8.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.852 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.456 ' HB2' ' CE1' ' A' ' 73' ' ' PHE . 65.7 t0 -82.08 -33.31 29.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.153 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.533 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 50.9 tpp -78.01 162.22 26.91 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.627 -0.26 . . . . 0.0 110.713 179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.424 ' N ' ' HG3' ' A' ' 13' ' ' MET . 43.0 t -39.67 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.269 -0.423 . . . . 0.0 112.126 -179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.44 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -178.5 -29.68 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.693 179.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -54.18 -34.58 60.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.739 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.533 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 24.0 mmt -74.9 -24.82 58.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.666 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.71 ' OE1' HD12 ' A' ' 74' ' ' ILE . 3.2 mp0 -67.5 -45.14 76.71 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -81.04 -31.44 34.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.241 179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.434 ' OD1' ' CZ ' ' A' ' 46' ' ' PHE . 10.2 t0 -77.03 -50.19 13.67 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.817 0.342 . . . . 0.0 110.681 -179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.771 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -65.57 -48.09 73.58 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.318 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 18' ' ' GLN . 88.7 t -62.44 -46.16 97.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.957 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 66.3 t0 -72.0 -34.87 69.22 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 121.138 -0.225 . . . . 0.0 110.702 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 48.9 t -68.9 -33.68 74.17 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.21 -27.08 53.34 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.523 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 92.7 m -74.96 -53.53 8.8 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.004 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.429 ' HG2' ' O ' ' A' ' 23' ' ' ASP . 24.4 pt20 -68.32 -23.28 64.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.376 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.634 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.93 -47.82 56.95 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.915 179.729 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 50.1 ttm -72.21 -27.14 62.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.16 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -79.44 -46.25 17.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HG3' ' CE1' ' A' ' 32' ' ' TYR . 16.9 tppt? -82.37 -24.19 34.62 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.824 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.51 ' CE1' ' HG3' ' A' ' 31' ' ' LYS . 7.6 m-85 -134.77 156.24 49.2 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 120.844 0.354 . . . . 0.0 110.621 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -143.86 23.66 1.72 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.115 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.468 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 31.9 mm -78.07 -16.55 13.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.59 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 86.4 mt-10 76.71 -54.12 0.58 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.975 -179.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -76.51 -50.32 14.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.357 179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.407 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 66.3 t0 -56.14 -29.84 61.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.194 -0.457 . . . . 0.0 109.945 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.634 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.4 mm -58.01 -53.05 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.351 179.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.594 ' HB2' ' CG2' ' A' ' 58' ' ' VAL . . . -62.25 -24.16 67.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.947 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -81.14 -38.09 27.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.839 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -70.82 -24.42 62.54 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.536 179.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.429 HG21 ' SG ' ' A' ' 56' ' ' CYS . 79.6 mt -84.91 -46.27 17.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 43' ' ' LYS . 5.3 tmtm? -64.31 -37.71 88.48 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.686 178.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 12.2 tppt? -70.71 -56.49 6.29 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.436 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -49.44 -40.17 35.76 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.512 -179.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.695 ' CE2' HD22 ' A' ' 85' ' ' LEU . 19.2 m-85 -68.37 -51.3 45.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.23 179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -68.62 -9.82 52.21 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 121.069 -0.252 . . . . 0.0 111.455 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -59.67 -28.32 67.16 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.502 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -164.07 32.14 0.08 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' A' ' 46' ' ' PHE . 3.4 m-85 -125.85 10.65 7.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.621 0.248 . . . . 0.0 111.196 179.207 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.4 m-80 62.99 134.64 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.785 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HB2' ' HB ' ' A' ' 53' ' ' THR . 54.8 Cg_endo -70.11 166.89 26.53 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.329 2.019 . . . . 0.0 112.099 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' A' ' 52' ' ' PRO . 8.8 t -130.75 122.35 27.09 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.234 0.614 . . . . 0.0 110.638 -0.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.418 ' CD1' ' N ' ' A' ' 54' ' ' TRP . 6.1 m95 -100.12 160.3 14.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.256 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 89.7 m-70 -131.58 62.38 1.63 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.96 0.41 . . . . 0.0 110.622 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.449 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.4 t -55.53 106.95 0.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.834 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.789 ' O ' HG23 ' A' ' 83' ' ' ILE . 25.1 mm -82.29 153.93 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.819 -179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.594 ' CG2' ' HB2' ' A' ' 39' ' ' ALA . 60.6 t -141.15 68.07 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.93 0.395 . . . . 0.0 110.739 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -174.33 -76.93 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.574 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.9 mtp85 -149.84 -77.91 0.14 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.725 0.298 . . . . 0.0 111.217 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.5 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -154.96 14.66 0.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.608 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.542 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 28.3 p90 -56.98 -16.31 6.7 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -177.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -130.13 51.58 0.85 Allowed Glycine 0 C--N 1.332 0.337 0 C-N-CA 120.535 -0.841 . . . . 0.0 112.507 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.654 ' O ' HG23 ' A' ' 66' ' ' VAL . 45.9 t -44.7 -76.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.765 0.316 . . . . 0.0 111.631 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 42.59 31.57 0.3 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.489 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.672 HG21 ' OH ' ' A' ' 75' ' ' TYR . 45.2 t -97.53 -2.84 10.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.8 m -114.01 -27.41 7.71 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.822 0.344 . . . . 0.0 111.09 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.577 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 25.5 t-80 -48.28 -27.86 2.75 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.136 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.577 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 15.5 pt-20 157.13 44.75 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.422 0.452 . . . . 0.0 111.396 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.748 HG22 ' H ' ' A' ' 72' ' ' HIS . 73.8 m -86.77 -81.89 0.22 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.333 -179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 70' ' ' THR . 46.7 mmtm 75.91 -3.73 2.51 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.548 -0.296 . . . . 0.0 111.649 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.748 ' H ' HG22 ' A' ' 70' ' ' THR . 0.3 OUTLIER -156.48 92.87 1.35 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.188 0.518 . . . . 0.0 110.716 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.502 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 8.3 p90 -122.62 -170.86 2.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.135 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.71 HD12 ' OE1' ' A' ' 18' ' ' GLN . 5.5 tt -162.42 110.94 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.567 178.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.806 ' O ' HG23 ' A' ' 8' ' ' ILE . 10.7 m-30 -99.51 140.12 34.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.457 -179.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.771 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.1 p90 -170.17 127.83 0.85 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.101 179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.529 ' CE1' ' HB ' ' A' ' 7' ' ' VAL . 8.3 p90 -114.47 145.98 41.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.212 0.53 . . . . 0.0 111.54 -179.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.742 HD22 ' O ' ' A' ' 5' ' ' LYS . 81.7 mt -115.58 117.59 30.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.495 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 67.67 -77.31 0.2 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.413 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.479 HE21 HG23 ' A' ' 81' ' ' VAL . 3.1 pm0 -149.56 24.93 0.87 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.752 0.311 . . . . 0.0 111.218 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.479 HG23 HE21 ' A' ' 80' ' ' GLN . 48.1 t -134.14 118.5 28.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.873 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.515 ' HA ' ' CB ' ' A' ' 77' ' ' TYR . . . -92.04 122.78 34.86 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.135 0.493 . . . . 0.0 112.063 -179.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.789 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.3 mp -100.47 133.29 44.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.187 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.73 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.4 mp -120.1 97.99 5.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 111.569 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.695 HD22 ' CE2' ' A' ' 46' ' ' PHE . 49.8 tp -98.69 134.62 41.35 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.692 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.502 ' HB3' ' CB ' ' A' ' 73' ' ' PHE . 7.0 p90 -171.89 163.96 6.32 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.626 -178.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HB3' ' NE2' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -113.77 81.21 1.48 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.609 179.109 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.594 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 89.3 p -69.02 67.58 0.16 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.843 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.34 -1.256 . . . . 0.0 112.52 179.889 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.875 0.369 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.4 m -98.8 109.58 22.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.911 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.9 52.54 2.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.976 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -152.76 146.33 25.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.953 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -168.63 30.64 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.074 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.584 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 61.69 132.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.36 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.441 ' HB ' ' CE1' ' A' ' 77' ' ' TYR . 48.7 t -142.58 110.27 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.052 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.666 HD13 ' OE1' ' A' ' 18' ' ' GLN . 62.4 mt -95.68 131.01 43.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.961 179.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' ' CE1' ' A' ' 77' ' ' TYR . 96.8 mttt -95.59 -38.24 10.49 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.565 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -144.26 115.77 8.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.291 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.605 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -108.32 128.05 54.41 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.644 -179.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.474 ' OD1' ' O ' ' A' ' 12' ' ' ASP . 9.8 t70 -138.45 -4.47 1.65 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.662 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 50.1 tpp -86.73 61.92 7.1 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 -179.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.459 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 80.2 p 53.05 18.01 1.04 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 178.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.624 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 39.4 tt0 70.5 -51.78 0.66 Allowed 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 178.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -48.4 -41.04 27.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.465 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.526 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.7 mpt? -71.52 -17.26 62.34 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.812 0.339 . . . . 0.0 110.946 179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.92 ' O ' HG23 ' A' ' 22' ' ' VAL . 81.2 mm-40 -68.19 -48.42 65.29 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 177.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -72.97 -39.17 66.36 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.833 179.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.416 ' HB3' ' HA ' ' A' ' 17' ' ' MET . 37.4 t70 -66.51 -54.11 27.49 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.048 0.452 . . . . 0.0 110.474 179.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -53.43 -43.89 68.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.871 179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.92 HG23 ' O ' ' A' ' 18' ' ' GLN . 75.2 t -54.77 -53.84 28.81 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.588 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -63.55 -31.8 73.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.443 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 77.4 m -70.81 -32.23 69.23 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 178.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.805 ' HB1' HD11 ' A' ' 78' ' ' LEU . . . -81.21 -26.28 36.05 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.852 178.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 93.1 m -76.88 -47.03 22.36 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.46 -27.33 63.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.04 178.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 24' ' ' CYS . . . -68.72 -45.92 70.28 Favored 'General case' 0 N--CA 1.456 -0.152 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.548 179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 94.1 mmm -75.69 -21.72 57.33 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.745 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.76 -48.53 12.37 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.019 0.437 . . . . 0.0 110.354 179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HB3' ' NZ ' ' A' ' 31' ' ' LYS . 7.9 mtpm? -75.63 -27.24 58.34 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.703 179.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.402 ' CD2' ' HB3' ' A' ' 37' ' ' ASP . 50.2 m-85 -140.68 162.06 36.28 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.664 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.455 ' OD1' ' O ' ' A' ' 33' ' ' ASN . 17.8 t-20 -146.64 29.71 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.953 0.406 . . . . 0.0 110.656 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.71 HG22 ' HG2' ' A' ' 35' ' ' GLU . 41.0 mt -94.05 -86.15 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.055 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HG2' HG22 ' A' ' 34' ' ' ILE . 15.4 pt-20 171.5 -39.02 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.903 0.383 . . . . 0.0 110.548 179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -82.09 -46.84 13.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.447 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB3' ' CD2' ' A' ' 32' ' ' TYR . 38.6 m-20 -57.53 -25.96 60.65 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.345 179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.0 mm -68.18 -59.57 3.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.54 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.751 ' HB2' HG21 ' A' ' 58' ' ' VAL . . . -61.3 -20.38 62.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.351 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.21 -43.94 22.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.208 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.438 ' O ' ' HB2' ' A' ' 45' ' ' GLU . 5.4 t80 -68.82 -28.02 66.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.934 0.397 . . . . 0.0 110.169 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 73.0 mt -82.17 -46.4 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 178.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -66.82 -32.7 74.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.81 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 58.2 mtpt -80.1 -31.4 39.22 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.218 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 41' ' ' TYR . 4.1 tm-20 -69.74 -34.14 73.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.673 0.273 . . . . 0.0 110.8 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.684 ' CD2' HD21 ' A' ' 85' ' ' LEU . 8.3 m-85 -88.93 -43.61 11.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 50.8 m-20 -68.88 -25.35 64.58 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 34.8 mmtp -90.26 27.6 1.62 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.641 0.258 . . . . 0.0 111.369 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -156.01 -45.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.767 0.318 . . . . 0.0 110.808 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.457 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 3.8 m-85 -102.19 7.47 40.87 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.431 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.4 m120 61.35 154.66 0.11 Allowed Pre-proline 0 C--N 1.332 -0.185 0 CA-C-O 120.75 0.31 . . . . 0.0 111.144 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.448 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 19.0 Cg_endo -60.11 173.79 1.69 Allowed 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 122.849 2.366 . . . . 0.0 112.053 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.448 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 88.4 m -116.63 117.32 29.5 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 123.206 0.602 . . . . 0.0 110.853 -0.007 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 14.6 m95 -108.75 153.07 23.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.588 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.452 ' CD2' HD11 ' A' ' 57' ' ' ILE . 78.0 t60 -136.43 89.47 2.47 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.601 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.596 ' HB3' HD13 ' A' ' 85' ' ' LEU . 30.8 p -82.21 124.68 30.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.192 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.819 ' O ' HG23 ' A' ' 83' ' ' ILE . 23.7 mm -88.41 153.86 3.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.277 179.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.751 HG21 ' HB2' ' A' ' 39' ' ' ALA . 58.6 t -133.24 76.93 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.28 -80.41 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.979 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 17.2 ptp180 -165.5 -48.92 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.918 0.39 . . . . 0.0 111.126 179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.563 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -173.39 21.1 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.47 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.537 ' CE1' HG23 ' A' ' 57' ' ' ILE . 7.9 p90 -71.25 -17.01 62.51 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.446 -177.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -56.52 -52.98 46.82 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.813 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 54.3 m 49.75 48.25 21.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.532 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 74.5 t80 -156.6 66.1 0.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.33 -179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.942 HG22 ' CE2' ' A' ' 86' ' ' PHE . 24.0 t -129.25 -55.26 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.995 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.5 m -55.05 -25.29 29.64 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.366 -179.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 65' ' ' TYR . 38.8 m80 -40.06 -30.45 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.123 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.474 ' O ' ' HB ' ' A' ' 70' ' ' THR . 65.7 mm-40 -135.31 -48.16 0.71 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.744 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.544 HG22 ' O ' ' A' ' 70' ' ' THR . 33.4 m 70.89 5.99 5.68 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.704 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.502 ' HG3' ' CD2' ' A' ' 72' ' ' HIS . 51.4 tptt -42.51 -29.61 0.29 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.739 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.507 ' CE1' ' HB3' ' A' ' 87' ' ' LYS . 6.8 p80 155.98 117.85 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.264 0.554 . . . . 0.0 110.959 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 13' ' ' MET . 23.7 p90 -118.99 -171.96 2.2 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.235 -0.893 . . . . 0.0 110.688 -179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.787 HD11 ' HA ' ' A' ' 18' ' ' GLN . 6.4 tt -172.45 108.58 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.622 178.512 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.536 ' O ' HG23 ' A' ' 8' ' ' ILE . 12.0 m-30 -95.67 142.48 27.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.585 -179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 9.0 p90 -168.41 137.16 2.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.508 179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.484 ' CB ' ' HA ' ' A' ' 82' ' ' ALA . 3.8 p90 -125.49 151.16 46.66 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.271 0.557 . . . . 0.0 112.211 -179.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.805 HD11 ' HB1' ' A' ' 25' ' ' ALA . 66.9 mt -115.14 106.02 13.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.01 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.31 -77.29 0.46 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.497 -0.859 . . . . 0.0 112.309 -179.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.485 ' NE2' ' N ' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -142.24 16.36 2.06 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 111.577 0.214 . . . . 0.0 111.577 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 47.0 t -123.94 112.02 31.19 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-O 120.726 0.298 . . . . 0.0 110.905 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.979 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -94.87 116.78 29.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.236 0.541 . . . . 0.0 112.135 -179.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.819 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.1 mp -95.18 136.46 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.898 179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.701 HD12 ' C ' ' A' ' 83' ' ' ILE . 5.5 mp -119.34 100.9 7.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.504 -179.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.684 HD21 ' CD2' ' A' ' 46' ' ' PHE . 62.6 tp -97.9 137.74 36.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 178.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.942 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.0 p90 -174.13 153.54 2.07 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 121.053 -0.259 . . . . 0.0 111.408 -178.334 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.507 ' HB3' ' CE1' ' A' ' 72' ' ' HIS . 2.4 tmmm? -104.91 82.78 1.91 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 109.899 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.452 ' HB2' ' CE2' ' A' ' 65' ' ' TYR . 57.3 m -83.65 63.21 7.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.894 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.137 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.546 179.93 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtm . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.977 0.418 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.4 p -67.53 132.48 47.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.006 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 61.34 32.89 19.09 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.015 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -73.25 -73.12 0.22 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.954 -180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 5' ' ' LYS . 37.9 ttpt -164.9 31.74 0.06 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.614 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . 179.35 97.51 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.09 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.2 t -135.14 90.74 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.093 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.689 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -80.88 91.09 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.905 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 10' ' ' ASN . 66.8 mttm -58.79 -20.09 46.86 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.541 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 19.9 t-20 173.47 129.66 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.675 179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.45 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -146.62 128.74 15.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.823 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -131.73 2.91 4.11 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.523 ' HB2' ' O ' ' A' ' 73' ' ' PHE . 55.8 ttp -96.47 62.57 2.05 Favored 'General case' 0 C--N 1.333 -0.14 0 C-N-CA 120.316 -0.554 . . . . 0.0 111.934 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.7 t 64.56 110.32 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.44 179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.511 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 56.0 mt-10 -40.45 -32.77 0.21 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.246 179.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 55.2 m-20 -53.94 -35.07 61.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.718 179.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.403 ' HB2' HD12 ' A' ' 74' ' ' ILE . 26.2 mmt -70.91 -24.42 62.46 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.824 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 3.5 mp0 -71.04 -41.11 71.24 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 178.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -77.8 -33.41 52.53 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.751 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 m-20 -76.3 -52.52 9.81 Favored 'General case' 0 CA--C 1.522 -0.109 0 CA-C-O 120.971 0.415 . . . . 0.0 110.668 179.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.85 -49.94 75.85 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.112 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' GLN . 94.4 t -60.37 -51.37 73.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.898 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -66.46 -29.28 69.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.74 0.305 . . . . 0.0 110.453 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 46.4 t -71.66 -32.3 67.76 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.44 -23.85 34.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.026 178.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 91.0 m -80.56 -44.21 19.38 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -74.45 -28.08 60.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.252 178.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.423 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -74.13 -50.18 20.54 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 179.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.4 tpt -68.46 -25.96 65.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.616 179.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -80.64 -47.22 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.065 0.459 . . . . 0.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.4 tptp -73.88 -25.03 59.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.678 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.5 m-85 -144.28 152.27 40.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.818 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -136.93 46.22 2.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.976 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 33.7 mt -98.18 -16.69 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.432 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.474 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 46.1 mm-40 77.94 -54.84 0.51 Allowed 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.864 -179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -74.42 -52.93 10.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.876 0.37 . . . . 0.0 110.516 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -55.75 -29.36 59.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.28 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.423 HG23 ' HB1' ' A' ' 28' ' ' ALA . 47.5 mm -60.07 -50.05 81.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.713 179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.6 -20.94 63.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.201 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.446 ' O ' ' HG2' ' A' ' 44' ' ' LYS . . . -82.68 -40.52 20.56 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.832 179.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -70.76 -26.23 63.26 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.194 179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 85.3 mt -83.41 -46.22 18.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 47' ' ' ASP . 35.2 ttmt -63.81 -37.69 88.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.267 178.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 12.8 mmmm -75.23 -31.86 60.97 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.771 179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.2 tp10 -58.96 -58.89 6.63 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.72 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.441 ' CD2' ' CD2' ' A' ' 85' ' ' LEU . 46.5 m-85 -69.91 -30.71 68.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.193 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 43' ' ' LYS . 62.7 t0 -64.65 -34.12 77.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.964 0.411 . . . . 0.0 110.96 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.551 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -90.27 30.43 1.11 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.816 179.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 27.8 mtpp -152.75 -43.49 0.1 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.352 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -112.57 0.45 15.46 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.757 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.4 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 5.3 m120 62.71 156.82 0.12 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.711 0.291 . . . . 0.0 111.287 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.429 ' CB ' ' HA ' ' A' ' 53' ' ' THR . 11.2 Cg_endo -54.49 173.52 0.24 Allowed 'Trans proline' 0 C--N 1.348 0.52 0 C-N-CA 122.862 2.375 . . . . 0.0 112.212 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.429 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 89.7 m -117.8 128.16 54.59 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.226 0.611 . . . . 0.0 110.463 -0.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.662 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 3.1 m95 -119.3 -168.67 1.61 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.053 0.454 . . . . 0.0 111.047 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -168.25 63.97 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.407 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.894 ' SG ' HD13 ' A' ' 85' ' ' LEU . 60.1 m -48.4 138.34 10.23 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.113 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.796 ' O ' HG23 ' A' ' 83' ' ' ILE . 20.0 mm -114.48 140.99 32.55 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.743 179.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 48.7 t -141.1 76.95 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.95 179.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -177.74 -66.93 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.284 -179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.763 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 99.4 mtt180 -154.97 -80.9 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.741 0.305 . . . . 0.0 111.057 179.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.507 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.92 17.88 0.12 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.324 -179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.684 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 25.1 p90 -52.8 -20.7 3.42 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.407 ' O ' ' CD1' ' A' ' 65' ' ' TYR . . . -58.52 -60.59 8.66 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.459 -0.877 . . . . 0.0 112.158 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p 49.6 26.23 1.7 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 179.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.426 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 13.8 m-30 -111.81 41.37 1.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.653 -0.248 . . . . 0.0 110.922 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.55 HG21 ' OH ' ' A' ' 75' ' ' TYR . 49.0 t -75.53 -71.34 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.815 0.34 . . . . 0.0 111.301 -179.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 85.5 m -76.97 -28.65 55.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.219 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.401 ' ND1' ' O ' ' A' ' 68' ' ' HIS . 26.1 t-80 -54.63 -21.05 9.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.198 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 88' ' ' SER . 10.3 pt-20 -110.01 -55.23 2.47 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.478 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.645 HG22 ' N ' ' A' ' 71' ' ' LYS . 28.3 m -162.89 -101.71 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.074 -179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.645 ' N ' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 179.95 25.81 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.789 0.328 . . . . 0.0 111.383 179.701 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.464 ' CE1' ' HE3' ' A' ' 71' ' ' LYS . 92.2 m-70 -107.83 68.02 0.7 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 0.0 109.967 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 13' ' ' MET . 36.7 p90 -107.04 -174.99 2.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.216 0.532 . . . . 0.0 111.425 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.585 HG23 ' O ' ' A' ' 74' ' ' ILE . 12.2 tt -169.65 109.13 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.5 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.55 ' OH ' HG21 ' A' ' 66' ' ' VAL . 56.1 m-85 -89.83 138.85 31.14 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.762 0.315 . . . . 0.0 111.186 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.642 ' CZ ' HG22 ' A' ' 83' ' ' ILE . 1.9 p90 -166.39 112.13 0.83 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.111 0.481 . . . . 0.0 110.824 179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 2.8 t80 -91.88 129.36 37.86 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.589 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 85.3 mt -119.29 134.94 54.94 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.892 0.377 . . . . 0.0 111.211 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 52.18 -103.92 0.14 Allowed Glycine 0 C--N 1.331 0.256 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.798 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.65 ' NE2' HG23 ' A' ' 81' ' ' VAL . 2.0 pp0? -128.12 33.04 4.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.921 0.391 . . . . 0.0 111.189 179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.65 HG23 ' NE2' ' A' ' 80' ' ' GLN . 88.6 t -146.06 140.64 21.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.581 179.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.763 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -93.25 131.69 38.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.796 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.796 HG23 ' O ' ' A' ' 57' ' ' ILE . 63.0 mt -127.4 132.54 69.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.455 -179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.655 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.4 OUTLIER -144.78 127.38 16.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.056 0.455 . . . . 0.0 111.579 -179.442 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.894 HD13 ' SG ' ' A' ' 56' ' ' CYS . 29.8 tp -109.11 141.04 41.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.915 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.602 ' H ' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -157.97 154.73 28.24 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.003 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.662 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -140.41 154.18 46.59 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.013 0.435 . . . . 0.0 111.688 -179.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 69' ' ' GLU . 92.9 p -81.28 76.86 8.21 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.079 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.516 ' HA3' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.329 -1.262 . . . . 0.0 112.766 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.2 mtm . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.844 0.354 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.1 m -150.21 155.34 39.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.884 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 54.2 p-10 -163.96 75.56 0.33 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.009 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 74.8 mtt-85 -80.78 -46.71 14.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.719 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp 59.56 80.4 0.2 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.773 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 63.48 128.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.069 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.45 HG12 ' HE2' ' A' ' 9' ' ' LYS . 46.2 t -144.36 88.68 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.028 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.575 HD13 ' HG3' ' A' ' 18' ' ' GLN . 79.5 mt -59.41 129.15 21.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.976 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.45 ' HE2' HG12 ' A' ' 7' ' ' VAL . 75.2 mmtt -112.02 -23.11 10.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.188 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -165.48 85.6 0.37 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.882 0.372 . . . . 0.0 110.863 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.431 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -106.97 95.69 5.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.878 179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -75.51 -11.16 59.97 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.368 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.484 ' HG2' ' CG ' ' A' ' 17' ' ' MET . 43.4 tpp -78.34 158.73 28.72 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.708 0.29 . . . . 0.0 110.735 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.4 m -41.63 -78.26 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.146 -0.479 . . . . 0.0 112.205 -179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.476 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 44.7 tt0 -178.27 -31.12 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.58 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -55.42 -32.17 62.49 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.844 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.484 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 1.1 mpt? -77.24 -24.84 51.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.563 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.662 ' OE1' HD12 ' A' ' 74' ' ' ILE . 2.0 mp0 -66.67 -45.46 78.82 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -82.21 -32.1 29.98 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.532 -0.758 . . . . 0.0 111.308 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 67.7 t0 -75.35 -47.55 27.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.964 0.411 . . . . 0.0 110.656 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.672 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -66.45 -49.14 67.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.139 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 18' ' ' GLN . 86.2 t -60.23 -41.61 87.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.79 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -77.12 -31.68 55.93 Favored 'General case' 0 CA--C 1.519 -0.223 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.625 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.554 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 37.9 t -72.07 -29.81 64.5 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 178.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -82.1 -26.89 33.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.977 178.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 95.3 m -78.9 -45.78 19.85 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.728 179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -72.35 -28.35 62.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.077 178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.743 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -67.53 -56.17 10.59 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.391 179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 67.1 mtm -70.11 -20.15 63.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.643 179.368 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -81.14 -45.03 17.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.672 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -83.78 -26.33 29.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.7 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.8 m-85 -137.65 170.03 16.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.771 179.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -154.48 54.79 0.68 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.555 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.466 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 21.4 mt -108.11 -11.11 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.477 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 7.9 mp0 72.69 -54.47 0.69 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.093 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -75.69 -50.23 16.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.556 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.406 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 7.6 t70 -57.16 -29.1 63.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.418 179.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.743 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.6 mm -60.9 -49.79 83.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.476 179.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.78 -23.66 63.46 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.119 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.474 ' HA ' ' HG3' ' A' ' 43' ' ' LYS . . . -75.99 -45.09 36.51 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.195 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.436 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.4 t80 -67.68 -25.82 65.88 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.902 0.382 . . . . 0.0 110.391 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.6 mt -80.92 -49.46 18.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.908 179.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.531 ' HB2' ' NZ ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -68.33 -31.48 70.92 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.072 179.068 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 40' ' ' ALA . 29.7 mmmt -72.51 -42.32 64.94 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.316 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 5.4 mm-40 -70.35 -27.88 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.437 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.501 ' CD2' HD21 ' A' ' 85' ' ' LEU . 32.2 m-85 -89.01 -38.87 14.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.539 0.209 . . . . 0.0 111.502 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -77.62 -25.43 49.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.679 0.276 . . . . 0.0 111.175 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -87.17 -11.97 48.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.193 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -110.22 -53.68 2.65 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.665 0.269 . . . . 0.0 111.21 -179.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE2' ' CE ' ' A' ' 17' ' ' MET . 52.5 m-85 -94.97 16.54 15.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.637 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.412 ' OD1' ' HD2' ' A' ' 52' ' ' PRO . 45.6 t30 62.61 138.68 0.04 OUTLIER Pre-proline 0 C--N 1.331 -0.197 0 CA-C-O 120.55 0.214 . . . . 0.0 110.851 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OD1' ' A' ' 51' ' ' ASN . 53.2 Cg_exo -55.52 172.49 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.248 1.965 . . . . 0.0 112.125 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.0 m -120.97 125.61 47.82 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.134 0.574 . . . . 0.0 110.789 0.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.452 ' CZ2' ' HG3' ' A' ' 87' ' ' LYS . 8.9 m95 -114.08 174.36 5.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.516 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.408 ' CG ' ' O ' ' A' ' 54' ' ' TRP . 92.2 m-70 -157.52 92.58 1.23 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.078 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.888 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.9 t -79.24 137.71 37.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.534 179.702 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.844 ' O ' HG23 ' A' ' 83' ' ' ILE . 13.8 mm -112.73 145.88 18.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 CA-C-O 120.748 0.308 . . . . 0.0 111.508 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.702 ' O ' HG13 ' A' ' 58' ' ' VAL . 14.1 p -123.61 75.1 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.684 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.711 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . -178.06 -88.95 0.07 OUTLIER Glycine 0 C--N 1.33 0.224 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.735 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.2 mmm-85 -135.29 -84.16 0.4 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.641 0.258 . . . . 0.0 111.318 -179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.499 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -151.11 12.79 0.67 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.651 -179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.512 ' CE1' ' CG2' ' A' ' 57' ' ' ILE . 25.6 p90 -60.01 -14.86 18.26 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.279 0.474 . . . . 0.0 112.279 -177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.432 ' HA3' ' CD1' ' A' ' 57' ' ' ILE . . . -117.14 43.47 1.63 Allowed Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.013 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 80.7 p -97.12 63.72 1.9 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.887 0.375 . . . . 0.0 110.635 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -119.99 45.15 2.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.54 -179.649 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.831 HG13 ' HB3' ' A' ' 88' ' ' SER . 97.4 t -130.82 -38.22 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.898 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.0 m -49.61 -27.31 4.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.32 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.404 ' O ' ' CG ' ' A' ' 68' ' ' HIS . 79.1 t60 -81.92 5.97 17.35 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.869 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.531 ' HG2' ' HB2' ' A' ' 88' ' ' SER . 17.5 tp10 -114.61 -33.91 5.38 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 120.784 0.325 . . . . 0.0 111.456 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.771 HG22 ' HD3' ' A' ' 71' ' ' LYS . 18.9 m -158.96 -95.97 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.887 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.771 ' HD3' HG22 ' A' ' 70' ' ' THR . 0.0 OUTLIER 156.36 2.23 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 178.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.426 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 20.3 m80 -79.2 60.96 3.19 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.162 0.506 . . . . 0.0 109.93 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.572 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 40.3 p90 -111.83 -168.14 1.27 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.926 -178.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.662 HD12 ' OE1' ' A' ' 18' ' ' GLN . 7.1 tt -168.57 148.99 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.265 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -128.19 153.15 47.22 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.006 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.672 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 19.0 p90 -170.2 123.96 0.72 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.358 0.599 . . . . 0.0 111.354 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -84.41 118.81 24.49 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.154 -179.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.773 HD23 ' HA ' ' A' ' 6' ' ' ALA . 85.6 mt -116.32 117.63 30.51 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.716 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 59.48 -105.75 0.79 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.594 -0.812 . . . . 0.0 112.338 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.64 ' NE2' HG23 ' A' ' 81' ' ' VAL . 1.9 pp0? -126.36 30.19 5.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.818 0.342 . . . . 0.0 111.269 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.711 HG13 ' HA2' ' A' ' 59' ' ' GLY . 85.2 t -142.53 133.81 24.83 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.37 179.182 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -92.53 118.51 31.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.691 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.844 HG23 ' O ' ' A' ' 57' ' ' ILE . 2.6 mp -103.11 137.04 32.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.009 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.677 HD12 ' CZ ' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -137.31 116.22 12.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.168 0.509 . . . . 0.0 111.899 -179.378 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.888 HD13 ' HB2' ' A' ' 56' ' ' CYS . 63.9 tp -107.18 135.27 48.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.364 179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.677 ' CZ ' HD12 ' A' ' 84' ' ' LEU . 1.5 m-85 -130.75 176.12 8.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.309 0.576 . . . . 0.0 112.24 -179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.452 ' HG3' ' CZ2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -141.82 85.62 1.95 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.474 179.433 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.831 ' HB3' HG13 ' A' ' 66' ' ' VAL . 99.1 p -71.07 108.0 4.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.818 -179.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.4 ' N ' ' HG3' ' A' ' 69' ' ' GLU . . . . . . . . 0 C--O 1.249 1.08 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.558 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.4 mtp . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.855 0.36 . . . . 0.0 111.157 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.6 t -146.98 68.36 1.16 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.822 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -108.57 39.5 1.98 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 63.4 mtt85 -149.63 177.01 10.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.932 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -135.4 42.79 2.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.833 179.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -176.32 82.06 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.896 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.526 ' O ' ' HB2' ' A' ' 76' ' ' PHE . 24.0 t -133.14 152.13 35.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.61 HD11 ' CG2' ' A' ' 22' ' ' VAL . 37.5 mt -115.74 114.95 47.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.509 179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -75.02 -38.24 61.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.1 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.614 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 0.9 OUTLIER -164.0 119.0 1.54 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.851 0.358 . . . . 0.0 110.73 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.677 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -143.89 140.03 29.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.373 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -131.9 7.68 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.619 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 17' ' ' MET . 52.2 tpp -72.0 62.96 0.47 Allowed 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 120.981 0.42 . . . . 0.0 111.409 -179.735 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.563 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 42.2 t 68.34 -63.22 0.34 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.414 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.563 ' HB2' ' O ' ' A' ' 14' ' ' SER . 41.2 tt0 150.56 -49.02 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.702 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -52.89 -24.87 10.08 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.873 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.527 ' HG2' ' HG2' ' A' ' 13' ' ' MET . 1.8 mpt? -81.85 -25.22 35.29 Favored 'General case' 0 CA--C 1.52 -0.174 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.28 178.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.679 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.9 mt-30 -65.75 -42.27 91.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 177.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -74.94 -39.79 61.17 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.185 179.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -71.58 -53.81 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.908 0.385 . . . . 0.0 110.764 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.55 -51.48 65.1 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.309 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.679 HG23 ' O ' ' A' ' 18' ' ' GLN . 70.7 t -56.46 -53.76 36.62 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.081 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -68.46 -23.26 64.57 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.854 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 42.5 t -72.6 -34.09 67.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -78.72 -27.06 44.84 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.827 178.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.524 HG22 ' OE2' ' A' ' 30' ' ' GLU . 89.9 m -77.06 -49.28 15.69 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.954 179.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -69.67 -25.6 63.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.285 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.572 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -72.63 -42.04 64.85 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.535 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 49.6 ttm -71.5 -31.26 66.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.738 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.524 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.2 mt-10 -79.35 -46.78 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.264 179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -77.04 -21.47 54.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.405 ' HB2' ' CD1' ' A' ' 38' ' ' ILE . 50.8 m-85 -144.37 149.43 36.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.842 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -136.85 43.22 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.029 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 30.6 mt -99.43 -16.16 7.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.418 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.475 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 48.4 mt-10 77.55 -54.81 0.53 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.005 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -75.33 -50.84 14.74 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.256 179.577 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -55.84 -28.12 54.88 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.08 0.467 . . . . 0.0 110.112 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -61.94 -57.87 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.416 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.15 -24.46 58.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.926 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.526 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -77.81 -42.45 33.76 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.017 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -69.41 -21.91 63.73 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.795 0.331 . . . . 0.0 110.917 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 88.3 mt -81.62 -50.36 16.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 179.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.503 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 18.6 ptpt -66.17 -38.64 88.55 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.662 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 1.1 mptm? -65.53 -45.87 81.77 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.812 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -55.58 -44.44 76.92 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 110.872 179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -74.34 -32.47 62.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.389 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.406 ' OD1' ' CD1' ' A' ' 54' ' ' TRP . 47.5 m-20 -74.32 -26.69 60.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.698 0.285 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -88.74 -15.62 34.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.512 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -111.96 -26.94 8.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.537 0.208 . . . . 0.0 111.311 -179.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -117.96 1.94 12.08 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.538 -179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.2 m120 61.73 153.46 0.11 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.69 0.281 . . . . 0.0 111.005 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.19 170.91 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.643 2.229 . . . . 0.0 112.145 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.2 m -117.74 119.89 36.29 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.05 0.54 . . . . 0.0 110.294 -0.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.608 ' CD2' ' HB3' ' A' ' 87' ' ' LYS . 21.9 m95 -108.63 -172.28 2.02 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.227 0.537 . . . . 0.0 111.596 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.433 ' O ' ' CE1' ' A' ' 86' ' ' PHE . 15.3 t-160 -171.77 115.44 0.37 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.911 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.417 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.5 t -102.09 145.58 29.14 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.954 0.407 . . . . 0.0 111.33 -179.25 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.867 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 27.3 mm -111.71 143.13 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.603 179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.673 ' O ' HG13 ' A' ' 58' ' ' VAL . 7.2 p -129.88 58.91 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.566 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -148.02 -109.74 0.56 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.433 -0.889 . . . . 0.0 112.859 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.608 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 37.6 mmt180 -123.43 -65.32 1.09 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.86 0.362 . . . . 0.0 111.38 -179.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.577 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.06 20.81 0.44 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.55 -179.361 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 15.0 p90 -76.32 17.04 0.39 Allowed 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.437 -0.505 . . . . 0.0 111.562 -177.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.422 ' HA3' HG13 ' A' ' 57' ' ' ILE . . . -87.63 28.69 5.73 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.016 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 79.9 p -71.87 57.71 0.32 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.258 0.552 . . . . 0.0 110.081 179.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.568 ' O ' ' CD2' ' A' ' 65' ' ' TYR . 65.9 t80 -146.28 24.53 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.347 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.769 HG11 ' HB3' ' A' ' 73' ' ' PHE . 43.6 t -85.96 -54.99 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.774 -179.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 89.5 m -50.91 -32.8 21.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.055 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -54.57 -23.41 16.63 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.217 0.532 . . . . 0.0 109.728 178.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.532 ' HB3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -93.71 -76.34 0.48 Allowed 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.219 179.06 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.837 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -163.45 -107.95 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.818 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.527 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -153.2 32.21 0.47 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.001 0.429 . . . . 0.0 110.899 179.298 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.443 ' C ' ' HE2' ' A' ' 13' ' ' MET . 37.9 m170 -109.24 72.16 0.8 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.451 179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.769 ' HB3' HG11 ' A' ' 66' ' ' VAL . 30.5 p90 -106.04 -172.14 2.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.293 -179.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.677 HG13 ' HB1' ' A' ' 11' ' ' ALA . 5.1 tt 166.37 107.52 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.007 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.614 ' CE2' ' HB3' ' A' ' 10' ' ' ASN . 0.3 OUTLIER -119.24 163.68 16.75 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.162 0.506 . . . . 0.0 111.619 178.855 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.526 ' HB2' ' O ' ' A' ' 7' ' ' VAL . 5.9 p90 -155.09 162.49 41.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.742 -179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -119.3 133.46 55.73 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.799 0.333 . . . . 0.0 111.053 -179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.909 ' O ' HD12 ' A' ' 78' ' ' LEU . 2.9 pp -140.47 141.0 35.45 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.979 179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 49.57 -97.25 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.636 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -141.19 29.62 1.82 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.868 0.366 . . . . 0.0 110.914 179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.4 t -140.72 133.23 31.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.862 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.608 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -100.0 128.62 46.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.01 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.795 HG23 ' O ' ' A' ' 57' ' ' ILE . 65.9 mt -115.51 138.26 46.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.629 ' C ' HD23 ' A' ' 84' ' ' LEU . 5.4 tt -130.18 117.04 19.3 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.612 -179.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.539 ' HB3' HG23 ' A' ' 74' ' ' ILE . 66.1 tp -109.7 144.17 38.45 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.553 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.665 ' CG ' HG22 ' A' ' 66' ' ' VAL . 3.8 p90 -165.06 179.79 6.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.892 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.608 ' HB3' ' CD2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -168.85 -177.98 3.2 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.132 0.491 . . . . 0.0 111.752 -179.735 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.837 ' HA ' HG22 ' A' ' 70' ' ' THR . 78.5 p -111.57 76.66 0.99 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.249 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.478 ' N ' ' HD3' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.511 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.806 0.336 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.9 p 50.4 -175.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -162.57 85.83 0.57 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.801 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.9 mtt85 -152.57 -175.77 5.43 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.612 ' HE3' ' HA ' ' A' ' 5' ' ' LYS . 1.5 tpmt? -168.79 97.48 0.38 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.74 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.508 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 66.73 101.04 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.08 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 47.4 t -141.06 104.72 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.939 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.695 ' N ' HD12 ' A' ' 8' ' ' ILE . 1.7 mp -81.81 91.63 2.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.916 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -57.16 -19.18 18.82 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.722 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 49.5 t30 179.17 130.96 0.08 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.359 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HB2' HG21 ' A' ' 8' ' ' ILE . . . -120.92 130.66 53.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.594 -179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -132.58 3.39 3.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.451 179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.653 ' HE2' ' HG2' ' A' ' 17' ' ' MET . 68.3 mmm -97.45 49.07 1.04 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 121.028 0.442 . . . . 0.0 111.669 179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.488 ' O ' ' HB3' ' A' ' 15' ' ' GLU . 51.1 m 70.48 -63.05 0.42 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.715 178.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.668 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 10.2 pt-20 159.23 -42.25 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.651 -179.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -52.5 -33.2 43.83 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.995 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.653 ' HG2' ' HE2' ' A' ' 13' ' ' MET . 1.1 mpt? -72.64 -28.29 62.65 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.199 179.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.769 ' HA ' HD11 ' A' ' 74' ' ' ILE . 55.8 mm-40 -63.26 -50.14 71.31 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 178.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -73.54 -34.02 64.99 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.081 179.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.444 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 39.1 t70 -74.89 -64.18 1.1 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.858 0.361 . . . . 0.0 110.463 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.532 ' HB1' ' CE2' ' A' ' 76' ' ' PHE . . . -49.3 -46.26 46.35 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.32 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 18' ' ' GLN . 53.8 t -59.29 -54.61 31.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.984 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -61.76 -29.07 69.89 Favored 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.636 179.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.8 m -71.32 -34.0 70.17 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -77.62 -28.45 51.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.62 178.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.604 HG22 ' OE2' ' A' ' 30' ' ' GLU . 86.7 m -74.58 -51.39 14.71 Favored 'General case' 0 CA--C 1.521 -0.159 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.609 179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.448 ' N ' ' OE1' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -68.1 -23.96 64.98 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.367 178.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.557 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.5 -46.57 63.45 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.848 179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 93.6 mmm -70.45 -29.83 66.51 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.968 179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.604 ' OE2' HG22 ' A' ' 26' ' ' THR . 51.6 mt-10 -78.39 -47.71 17.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.356 179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -75.8 -21.23 57.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.75 179.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -140.76 140.1 34.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.858 0.361 . . . . 0.0 111.03 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 -111.02 29.28 7.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.932 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG22 ' H ' ' A' ' 35' ' ' GLU . 9.5 mt -116.46 172.27 4.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.609 ' H ' HG22 ' A' ' 34' ' ' ILE . 50.3 mt-10 -111.03 15.12 21.85 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.712 0.291 . . . . 0.0 111.296 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -119.48 -52.96 2.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.836 0.35 . . . . 0.0 110.254 179.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.81 -23.51 52.87 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.012 0.434 . . . . 0.0 109.912 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.557 HG23 ' HB1' ' A' ' 28' ' ' ALA . 37.3 mm -65.57 -57.34 11.23 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.681 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.67 62.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.407 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -83.86 -41.55 17.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.966 0.412 . . . . 0.0 110.959 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.453 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 6.5 t80 -73.35 -22.55 60.26 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.961 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 83.8 mt -86.39 -43.05 16.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.381 0.61 . . . . 0.0 109.459 178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.532 ' O ' ' HD2' ' A' ' 43' ' ' LYS . 0.3 OUTLIER -71.66 -37.09 70.83 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.728 179.111 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.5 mttt -75.7 -44.03 44.21 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.3 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.454 ' HA ' ' HG2' ' A' ' 48' ' ' LYS . 37.6 tt0 -61.69 -36.48 81.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.135 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.549 ' CD2' HD21 ' A' ' 85' ' ' LEU . 7.9 m-85 -74.92 -40.62 60.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.64 0.257 . . . . 0.0 111.517 179.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -75.99 -14.46 60.23 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HG2' ' HA ' ' A' ' 45' ' ' GLU . 4.0 ptpp? -82.91 3.94 27.77 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.929 -179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -152.25 -44.79 0.1 Allowed 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.444 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.1 m-30 -78.69 -4.1 47.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.372 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 62.99 141.62 0.05 OUTLIER Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.707 0.289 . . . . 0.0 110.709 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.9 170.67 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.366 2.044 . . . . 0.0 112.163 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.467 ' O ' HG23 ' A' ' 53' ' ' THR . 7.6 t -120.97 111.51 17.59 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 123.089 0.556 . . . . 0.0 110.576 -0.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.528 ' CG ' ' HB3' ' A' ' 87' ' ' LYS . 10.3 m95 -101.46 168.49 9.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.06 -179.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 45.4 m80 -151.81 99.48 2.58 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.758 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.885 ' HB3' HD13 ' A' ' 85' ' ' LEU . 29.4 p -90.78 130.0 36.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.812 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.84 ' O ' HG23 ' A' ' 83' ' ' ILE . 11.9 mm -109.3 149.6 12.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.345 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 49.0 t -134.79 90.07 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.984 179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.466 ' HA2' HG13 ' A' ' 81' ' ' VAL . . . 175.56 -74.12 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.332 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 56.0 mtp85 -153.11 -78.64 0.11 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.887 0.375 . . . . 0.0 111.279 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.565 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.01 24.22 0.11 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.758 -179.572 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.504 ' CZ ' ' CG2' ' A' ' 57' ' ' ILE . 25.8 p90 -67.83 8.58 0.37 Allowed 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 64' ' ' SER . . . -64.95 -67.01 2.19 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.282 -0.961 . . . . 0.0 111.945 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' A' ' 63' ' ' GLY . 24.9 m 78.55 41.04 0.11 Allowed 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 179.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.416 ' O ' ' CE2' ' A' ' 86' ' ' PHE . 5.3 p90 -179.31 65.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.807 0.337 . . . . 0.0 111.026 178.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.606 HG21 ' OH ' ' A' ' 75' ' ' TYR . 44.6 t -97.58 -63.75 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.202 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -90.71 -27.94 18.65 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.905 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 25.9 t-80 -52.68 -22.2 4.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.311 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.553 ' HG3' HG22 ' A' ' 70' ' ' THR . 22.5 pt-20 -90.44 -59.56 2.15 Favored 'General case' 0 C--O 1.232 0.147 0 C-N-CA 121.106 -0.238 . . . . 0.0 111.225 -179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.674 HG22 ' HA ' ' A' ' 88' ' ' SER . 4.6 t -147.4 -112.94 0.08 Allowed 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 110.579 -0.156 . . . . 0.0 110.579 179.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.644 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -166.58 33.33 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.078 0.466 . . . . 0.0 110.261 179.466 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -120.48 76.36 1.18 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.129 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.518 ' C ' ' HG2' ' A' ' 13' ' ' MET . 30.9 p90 -126.99 151.07 49.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.905 -0.588 . . . . 0.0 111.673 -178.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.769 HD11 ' HA ' ' A' ' 18' ' ' GLN . 7.9 tt -133.6 128.43 54.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.709 178.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.606 ' OH ' HG21 ' A' ' 66' ' ' VAL . 32.5 m-85 -112.74 138.91 48.86 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.227 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.532 ' CE2' ' HB1' ' A' ' 21' ' ' ALA . 16.7 p90 -162.88 129.64 3.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.235 0.541 . . . . 0.0 110.955 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.572 ' O ' HD23 ' A' ' 78' ' ' LEU . 33.1 t80 -92.36 150.15 21.0 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.73 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD23 ' O ' ' A' ' 77' ' ' TYR . 90.5 mt -149.21 130.5 14.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.937 0.399 . . . . 0.0 111.104 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 53.08 -98.47 0.03 OUTLIER Glycine 0 CA--C 1.517 0.213 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.916 179.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -136.14 31.87 2.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.798 0.332 . . . . 0.0 110.85 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.466 HG13 ' HA2' ' A' ' 59' ' ' GLY . 60.8 t -148.61 137.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.972 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.401 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -97.43 133.96 41.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.022 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.84 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.1 mt -117.78 138.14 49.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.478 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.618 ' N ' HD23 ' A' ' 84' ' ' LEU . 0.3 OUTLIER -133.93 103.41 5.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.963 0.411 . . . . 0.0 111.368 -179.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.885 HD13 ' HB3' ' A' ' 56' ' ' CYS . 44.8 tp -96.39 108.46 20.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.594 179.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.49 ' CD2' ' HA ' ' A' ' 66' ' ' VAL . 1.6 p90 -132.81 142.75 49.13 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.182 -179.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.528 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -123.24 150.99 42.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.627 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.674 ' HA ' HG22 ' A' ' 70' ' ' THR . 82.7 p -93.64 165.36 12.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.92 179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.525 179.943 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 83.7 mtp . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.796 0.332 . . . . 0.0 111.254 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.4 p -60.33 119.72 8.47 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.919 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -149.69 79.87 1.38 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.933 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.4 ptm180 -130.33 28.2 4.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.156 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -104.06 31.44 4.54 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.642 ' HB1' HG13 ' A' ' 22' ' ' VAL . . . 63.53 134.45 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.135 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 46.4 t -149.7 153.69 10.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.006 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.714 HD13 ' OE1' ' A' ' 18' ' ' GLN . 59.6 mt -130.42 115.79 33.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.043 179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? -81.03 -30.65 34.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.711 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -159.03 133.37 7.82 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.774 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.421 ' HB1' ' CD ' ' A' ' 18' ' ' GLN . . . -116.98 128.57 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.134 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -122.32 -16.01 7.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.523 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.54 ' HG2' ' HB2' ' A' ' 17' ' ' MET . 50.3 tpp -88.53 50.56 1.99 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.106 0.479 . . . . 0.0 111.822 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.63 ' O ' ' HB2' ' A' ' 15' ' ' GLU . 49.7 m 67.79 -65.25 0.25 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.778 -0.647 . . . . 0.0 111.821 179.054 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.696 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 tm-20 166.74 -36.18 0.0 OUTLIER 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.567 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 17' ' ' MET . 2.7 p30 -51.35 -40.78 59.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.805 -179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.54 ' HB2' ' HG2' ' A' ' 13' ' ' MET . 44.8 ttm -72.24 -18.59 61.81 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.503 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.714 ' OE1' HD13 ' A' ' 8' ' ' ILE . 71.8 mm-40 -66.51 -48.4 69.91 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 177.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -69.8 -38.61 76.68 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.863 178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -72.15 -63.91 1.05 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.211 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -48.15 -44.92 32.75 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.316 -179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.642 HG13 ' HB1' ' A' ' 6' ' ' ALA . 55.4 t -60.6 -53.31 50.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.035 179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -63.71 -29.85 71.03 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 120.694 0.283 . . . . 0.0 110.733 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 73.1 m -71.78 -31.46 66.63 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.505 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB1' ' CD1' ' A' ' 78' ' ' LEU . . . -83.44 -24.31 31.9 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.056 178.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.1 m -80.68 -42.57 21.8 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -75.36 -29.0 59.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.064 178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.748 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -70.85 -47.24 60.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.523 179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.493 ' CE ' HG21 ' A' ' 38' ' ' ILE . 26.4 mmt -74.3 -23.61 59.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.763 179.429 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -77.37 -51.12 11.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.4 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -81.34 -24.78 36.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.083 179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 48.5 m-85 -135.35 168.85 18.44 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.822 0.344 . . . . 0.0 110.874 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.7 p30 -159.14 44.85 0.26 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.066 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG21 ' OD2' ' A' ' 37' ' ' ASP . 31.5 mt -96.83 -16.68 7.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.088 -179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.468 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 85.5 mt-10 79.38 -53.07 0.42 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.056 -0.52 . . . . 0.0 112.095 179.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HD3' ' N ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -79.6 -42.36 25.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.615 0.245 . . . . 0.0 110.863 -179.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.609 ' OD2' HG21 ' A' ' 34' ' ' ILE . 52.6 m-20 -68.86 -17.99 64.07 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.022 0.439 . . . . 0.0 110.222 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.748 HG23 ' HB1' ' A' ' 28' ' ' ALA . 43.5 mm -72.38 -54.06 17.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.4 -26.93 63.79 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.978 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.605 ' O ' ' HB2' ' A' ' 44' ' ' LYS . . . -78.16 -38.11 44.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.837 179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 41' ' ' TYR . 5.9 t80 -68.61 -24.69 64.61 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.968 0.413 . . . . 0.0 110.341 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 84.3 mt -77.84 -53.28 14.58 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.755 179.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 40' ' ' ALA . 64.7 pttt -66.02 -35.88 81.75 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 116.068 -0.515 . . . . 0.0 109.657 178.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 14.0 tppt? -61.66 -47.23 86.31 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.798 179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 tt0 -58.75 -52.47 65.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.265 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.452 ' CE2' ' HG3' ' A' ' 17' ' ' MET . 13.2 m-85 -67.77 -29.44 68.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.747 0.308 . . . . 0.0 110.88 179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -70.7 -26.62 63.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.021 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.477 ' NZ ' ' HB3' ' A' ' 48' ' ' LYS . 7.2 ttpm? -89.85 -27.47 19.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.224 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -95.55 -50.45 4.96 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.144 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -91.67 9.3 32.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.371 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 60.69 154.25 0.1 Allowed Pre-proline 0 C--N 1.332 -0.176 0 CA-C-O 120.782 0.325 . . . . 0.0 110.901 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.99 172.12 1.82 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.571 2.181 . . . . 0.0 112.055 179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.573 ' O ' HG23 ' A' ' 53' ' ' THR . 9.0 t -121.96 97.11 5.33 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 122.957 0.503 . . . . 0.0 110.651 -0.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.456 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 13.6 m95 -90.46 172.16 8.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.591 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 86' ' ' PHE . 77.5 t60 -155.06 105.26 2.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.588 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 53.0 t -75.48 145.96 41.01 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.164 -179.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 62' ' ' PHE . 35.9 mm -111.89 145.46 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.885 179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.752 ' O ' HG13 ' A' ' 58' ' ' VAL . 9.6 p -133.53 63.82 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 121.246 0.546 . . . . 0.0 111.503 179.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -157.1 -92.47 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.448 179.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -125.75 -84.85 0.63 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.715 0.293 . . . . 0.0 111.088 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.501 HD22 ' C ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -158.72 15.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.47 -179.811 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 57' ' ' ILE . 9.7 p90 -53.97 -46.13 71.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.826 0.346 . . . . 0.0 111.353 -177.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.47 ' HA3' HG23 ' A' ' 66' ' ' VAL . . . 79.47 -21.28 4.51 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.626 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 63' ' ' GLY . 26.3 t 70.69 -53.43 0.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.915 0.358 . . . . 0.0 111.123 -179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -164.88 69.66 0.16 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.124 0.487 . . . . 0.0 111.256 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.612 HG22 ' CD2' ' A' ' 86' ' ' PHE . 42.1 t -91.26 -74.95 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.326 -179.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.8 m -43.6 -29.4 0.48 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -178.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.522 ' O ' ' HB3' ' A' ' 69' ' ' GLU . 75.4 m-70 -44.97 -26.77 0.46 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 68' ' ' HIS . 12.2 pt-20 167.43 50.14 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 120.97 0.414 . . . . 0.0 111.158 179.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.547 HG21 HG13 ' A' ' 66' ' ' VAL . 35.7 m -102.93 -86.89 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.444 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.515 ' HB2' ' O ' ' A' ' 70' ' ' THR . 0.1 OUTLIER 72.44 -18.24 0.34 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.333 -179.075 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.461 ' HB3' ' CE ' ' A' ' 13' ' ' MET . 53.3 m170 -122.23 77.33 1.39 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.738 0.304 . . . . 0.0 110.286 179.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.438 ' C ' ' CD1' ' A' ' 73' ' ' PHE . 6.4 p90 -125.43 -172.27 2.56 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.047 0.451 . . . . 0.0 111.434 -179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.525 HD11 ' HA ' ' A' ' 18' ' ' GLN . 9.5 tt -157.8 129.7 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.259 178.596 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.682 ' O ' HG23 ' A' ' 8' ' ' ILE . 8.2 m-30 -106.63 130.78 54.32 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.518 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.475 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.8 p90 -152.73 123.26 7.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.238 0.542 . . . . 0.0 111.411 179.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -93.2 140.7 29.23 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.721 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.677 HD23 ' N ' ' A' ' 78' ' ' LEU . 1.3 pt? -154.17 138.04 16.26 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.97 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 66.89 -100.82 0.59 Allowed Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.541 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -140.99 23.68 2.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.737 0.303 . . . . 0.0 111.003 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 61.1 t -150.78 150.02 13.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.125 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -97.76 130.47 44.71 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.018 179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.611 HG23 ' O ' ' A' ' 57' ' ' ILE . 66.0 mt -110.34 137.7 41.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.178 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.645 HD23 ' N ' ' A' ' 85' ' ' LEU . 3.6 tt -129.57 119.6 23.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.945 0.402 . . . . 0.0 111.539 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.645 ' N ' HD23 ' A' ' 84' ' ' LEU . 57.3 tp -109.61 119.75 40.36 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 178.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.612 ' CD2' HG22 ' A' ' 66' ' ' VAL . 6.3 p90 -136.87 173.08 12.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.438 0.637 . . . . 0.0 112.45 -178.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.456 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -134.9 84.53 2.11 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.464 179.024 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 70' ' ' THR . 80.0 p -72.22 68.22 0.72 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.463 -179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.432 -1.204 . . . . 0.0 112.447 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 ttp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.828 0.347 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.1 p -121.11 105.01 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.874 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -98.5 31.21 2.93 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.952 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.425 ' NE ' ' HA ' ' A' ' 4' ' ' ARG . 4.9 mmp_? -148.71 -174.03 4.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.917 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -155.94 42.47 0.4 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.835 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.42 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . . . -160.25 81.13 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.318 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 40.3 t -134.05 147.01 30.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.04 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.468 HG12 ' HB3' ' A' ' 76' ' ' PHE . 25.7 mt -121.64 112.85 36.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.896 0.379 . . . . 0.0 110.793 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' A' ' 9' ' ' LYS . 3.3 mmmp? -66.53 -43.31 85.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.719 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.565 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 49.8 t30 -161.39 138.91 8.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.961 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -138.12 94.99 2.94 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.385 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.488 ' HB2' ' CZ ' ' A' ' 73' ' ' PHE . 33.5 t70 -80.58 -1.74 43.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.653 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.459 ' HE1' ' HB3' ' A' ' 72' ' ' HIS . 47.8 tpp -86.18 165.13 16.78 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.406 ' N ' ' HG3' ' A' ' 13' ' ' MET . 80.4 p -36.4 -81.11 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.757 0.313 . . . . 0.0 111.818 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' HA ' ' NE2' ' A' ' 18' ' ' GLN . 12.0 pt-20 176.76 -36.83 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.207 0.527 . . . . 0.0 110.184 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -56.8 -24.6 51.75 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.582 179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.402 ' CG ' ' HG2' ' A' ' 13' ' ' MET . 2.0 mpt? -80.06 -28.29 39.24 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.448 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.77 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.0 mt-30 -65.18 -47.08 78.25 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -77.25 -35.43 55.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.212 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.446 ' OD2' ' CZ ' ' A' ' 46' ' ' PHE . 38.4 t70 -71.07 -53.33 15.05 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.779 -0.368 . . . . 0.0 110.265 179.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.66 -49.86 67.03 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.0 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.77 HG23 ' O ' ' A' ' 18' ' ' GLN . 80.1 t -54.65 -49.87 64.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 C-N-CA 121.003 -0.279 . . . . 0.0 111.099 179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -71.36 -27.31 63.26 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.022 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 28' ' ' ALA . 95.3 m -71.79 -33.49 68.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.439 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -80.32 -25.75 39.13 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.968 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 90.5 m -79.17 -45.75 19.29 Favored 'General case' 0 CA--C 1.521 -0.14 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.904 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -73.69 -25.28 60.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.279 179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.633 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -71.96 -53.26 13.58 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.777 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 66.2 mtt -73.48 -20.7 60.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.101 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 17.6 tp10 -78.04 -50.67 11.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.879 0.371 . . . . 0.0 110.741 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -81.99 -23.61 35.91 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.141 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -131.89 165.91 22.81 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.85 0.357 . . . . 0.0 111.05 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 74.3 m-80 -156.02 35.88 0.34 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.998 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 29.7 mt -98.3 -10.58 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.519 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 78.12 -55.1 0.5 Allowed 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.105 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -68.42 -53.04 26.35 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.676 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -56.81 -25.39 55.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.257 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.633 HG23 ' HB1' ' A' ' 28' ' ' ALA . 45.3 mm -65.63 -55.86 17.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.499 179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.32 -23.39 64.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.985 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.424 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -80.24 -39.0 29.9 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.851 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -68.27 -27.16 66.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.954 0.406 . . . . 0.0 110.088 179.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.409 HG21 ' SG ' ' A' ' 56' ' ' CYS . 76.2 mt -80.85 -48.67 19.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.652 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -67.23 -31.77 72.36 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.086 179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 98.1 mttt -80.48 -29.43 37.42 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.029 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -69.1 -39.5 78.95 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.823 0.344 . . . . 0.0 111.167 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.639 ' CD2' HD21 ' A' ' 85' ' ' LEU . 3.8 m-85 -82.05 -36.09 28.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.257 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.07 -17.63 56.76 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 21.8 ptmt -85.59 3.79 39.12 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 121.032 -0.267 . . . . 0.0 111.446 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 48' ' ' LYS . 10.4 mtmp? -142.7 -48.06 0.33 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.926 0.393 . . . . 0.0 110.829 179.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 7.8 m-30 -87.51 6.26 35.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.44 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 60.59 156.07 0.11 Allowed Pre-proline 0 C--N 1.332 -0.189 0 CA-C-O 120.727 0.299 . . . . 0.0 110.721 -179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.453 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 39.8 Cg_exo -56.65 167.03 3.13 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.394 2.063 . . . . 0.0 112.053 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 52' ' ' PRO . 9.0 t -139.08 126.98 22.21 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.241 0.616 . . . . 0.0 110.565 0.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.735 ' CD2' ' HB2' ' A' ' 87' ' ' LYS . 1.3 m95 -112.19 -171.28 1.82 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.292 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.503 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 50.1 m80 -157.39 58.2 0.5 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.281 178.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.855 ' HB2' HD13 ' A' ' 85' ' ' LEU . 53.0 t -48.91 133.52 17.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.673 -179.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.795 HG23 ' CZ ' ' A' ' 62' ' ' PHE . 30.9 mm -106.05 142.21 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.687 179.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.739 ' O ' HG13 ' A' ' 58' ' ' VAL . 10.9 p -129.73 72.16 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.477 -179.546 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -172.66 -92.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.271 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.145 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.504 ' O ' ' CG ' ' A' ' 61' ' ' ASN . 11.5 mtp-105 -157.59 67.24 0.5 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.653 0.263 . . . . 0.0 110.894 -179.594 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.504 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER 52.15 12.9 0.24 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.394 179.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.795 ' CZ ' HG23 ' A' ' 57' ' ' ILE . 5.8 p90 -51.67 -25.87 8.05 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 111.311 -178.327 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.412 ' N ' ' CD1' ' A' ' 62' ' ' PHE . . . -121.29 48.06 0.98 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.701 179.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.44 ' HA ' HD23 ' A' ' 84' ' ' LEU . 79.9 p -77.6 56.63 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.539 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.404 ' O ' ' HB3' ' A' ' 68' ' ' HIS . 3.1 p90 -98.73 37.7 1.46 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.102 0.477 . . . . 0.0 110.448 179.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.952 HG22 ' CD2' ' A' ' 86' ' ' PHE . 66.2 t -46.15 -54.26 2.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.597 179.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.5 m -50.8 -32.54 20.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.052 -179.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.404 ' HB3' ' O ' ' A' ' 65' ' ' TYR . 19.0 t-160 -53.65 -24.01 12.97 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.561 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.564 ' HA ' ' HB2' ' A' ' 88' ' ' SER . 9.5 mp0 -92.78 -77.51 0.44 Allowed 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.598 179.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.874 HG22 ' HA ' ' A' ' 88' ' ' SER . 1.8 t -176.55 -95.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.845 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.74 ' H ' HG23 ' A' ' 70' ' ' THR . 2.4 mptp? -152.79 22.62 0.59 Allowed 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 111.486 0.18 . . . . 0.0 111.486 -179.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.459 ' HB3' ' HE1' ' A' ' 13' ' ' MET . 43.3 m170 -113.12 73.7 0.83 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.987 0.422 . . . . 0.0 110.856 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.528 ' CB ' ' HB3' ' A' ' 86' ' ' PHE . 5.8 p90 -113.68 -179.87 3.76 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.801 -179.388 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.502 HG23 ' O ' ' A' ' 74' ' ' ILE . 7.7 tt 176.39 108.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.998 179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.565 ' CZ ' ' HB3' ' A' ' 10' ' ' ASN . 1.1 p90 -113.64 162.57 16.08 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.23 0.538 . . . . 0.0 111.513 179.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.573 ' HE2' HD11 ' A' ' 78' ' ' LEU . 1.3 p90 -153.38 159.05 42.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.111 -179.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.451 ' HB2' ' HG2' ' A' ' 9' ' ' LYS . 1.4 t80 -109.78 121.5 45.36 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.96 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.573 HD11 ' HE2' ' A' ' 76' ' ' PHE . 78.7 mt -119.86 112.26 18.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.053 179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 58.41 -90.25 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.75 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -138.42 31.89 2.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.81 0.338 . . . . 0.0 110.909 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 53.6 t -146.55 126.14 5.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.812 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -95.09 134.9 37.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.27 -179.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.778 HG23 ' O ' ' A' ' 57' ' ' ILE . 68.7 mt -115.43 135.8 54.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.651 179.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' A' ' 64' ' ' SER . 52.1 tp -124.36 107.01 10.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.952 0.406 . . . . 0.0 111.307 -179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.855 HD13 ' HB2' ' A' ' 56' ' ' CYS . 59.8 tp -108.64 130.61 55.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.561 179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.952 ' CD2' HG22 ' A' ' 66' ' ' VAL . 2.9 p90 -157.54 151.85 24.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.336 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.735 ' HB2' ' CD2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -127.92 152.87 47.34 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.244 0.545 . . . . 0.0 111.774 -179.604 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.874 ' HA ' HG22 ' A' ' 70' ' ' THR . 33.1 t -100.57 77.01 1.87 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.288 179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.538 ' O ' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.402 -1.221 . . . . 0.0 112.406 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.51 ' HA ' ' CE ' ' A' ' 1' ' ' MET . 10.4 mmt . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.862 0.363 . . . . 0.0 111.005 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 47.4 t 60.04 31.67 20.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.885 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 62.29 90.26 0.08 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.946 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 39.6 ptt180 -124.88 42.68 3.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.672 179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.409 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 22.1 pttp -113.9 50.01 0.95 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.847 -179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.44 ' HA ' HD23 ' A' ' 78' ' ' LEU . . . 67.27 108.86 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.21 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.7 97.98 3.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.858 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.731 HG22 ' H ' ' A' ' 10' ' ' ASN . 1.7 mp -66.28 124.77 22.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.831 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 10' ' ' ASN . 3.1 tppp? -98.77 36.4 1.67 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.262 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.731 ' H ' HG22 ' A' ' 8' ' ' ILE . 27.0 t-20 95.22 113.94 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -152.08 134.27 15.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.908 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -132.71 15.06 4.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 -179.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.436 ' CB ' ' O ' ' A' ' 73' ' ' PHE . 39.8 ttp -100.74 84.1 2.67 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.418 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 75.3 p 53.72 99.71 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.552 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.726 ' HA ' ' HG2' ' A' ' 18' ' ' GLN . 65.3 mm-40 -43.27 -31.76 0.68 Allowed 'General case' 0 C--O 1.24 0.6 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.256 179.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -53.51 -27.1 23.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.358 179.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.482 ' CB ' HD12 ' A' ' 74' ' ' ILE . 66.6 mtt -79.98 -21.21 43.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.898 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 33.4 mm-40 -69.31 -42.42 75.41 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -72.02 -41.43 67.56 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.959 -1.019 . . . . 0.0 111.329 179.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.54 -51.29 20.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' A' ' 76' ' ' PHE . . . -54.1 -46.14 72.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.065 179.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' GLN . 74.1 t -59.76 -59.6 3.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.644 179.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -62.48 -23.79 67.11 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.615 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.767 ' SG ' HG23 ' A' ' 42' ' ' ILE . 42.1 t -71.54 -33.43 69.14 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 178.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' CD1' ' A' ' 78' ' ' LEU . . . -83.0 -20.98 34.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.236 178.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.4 m -84.07 -42.65 15.9 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.002 179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -76.91 -28.78 55.43 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.431 179.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.658 ' HB1' HG23 ' A' ' 38' ' ' ILE . . . -77.34 -47.14 20.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.447 179.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 26.1 mmt -70.34 -26.5 63.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.676 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -79.39 -49.03 13.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.223 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -78.83 -21.41 47.71 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.319 179.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -132.66 151.86 51.84 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.829 0.347 . . . . 0.0 111.073 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.415 ' CA ' HD11 ' A' ' 38' ' ' ILE . 23.8 p30 -141.53 30.07 1.73 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.031 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.47 ' O ' ' HB2' ' A' ' 35' ' ' GLU . 37.5 mt -87.92 -17.5 8.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.196 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 55.4 mm-40 76.83 -52.68 0.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.409 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.3 mttp -82.0 -52.14 7.34 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.716 0.293 . . . . 0.0 111.378 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -60.71 -28.67 68.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.034 0.445 . . . . 0.0 110.394 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.658 HG23 ' HB1' ' A' ' 28' ' ' ALA . 9.4 mt -67.12 -49.05 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.064 -179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.68 -27.44 62.88 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.778 0.323 . . . . 0.0 110.887 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.468 ' O ' ' HG3' ' A' ' 44' ' ' LYS . . . -79.93 -35.36 37.89 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' GLU . 48.7 t80 -67.38 -26.65 66.56 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 0.0 109.945 179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.767 HG23 ' SG ' ' A' ' 24' ' ' CYS . 75.7 mt -79.91 -51.43 16.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 58.7 tttm -61.22 -35.99 78.72 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.427 178.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ALA . 62.6 mttm -63.58 -52.26 61.77 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.835 179.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' TYR . 65.3 mm-40 -49.58 -51.31 38.06 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.142 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -64.72 -27.19 68.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.739 0.304 . . . . 0.0 111.123 179.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -81.79 -25.37 35.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.157 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -84.26 4.2 31.96 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.543 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.428 ' HG3' ' CD2' ' A' ' 50' ' ' TYR . 18.3 ptpt -130.25 -44.15 1.15 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.825 0.345 . . . . 0.0 111.073 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' CD2' ' HG3' ' A' ' 49' ' ' LYS . 46.7 m-85 -103.86 -2.31 26.45 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.509 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 62.03 153.91 0.11 Allowed Pre-proline 0 C--N 1.332 -0.193 0 CA-C-O 120.7 0.286 . . . . 0.0 110.959 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -53.3 169.47 0.45 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.568 2.178 . . . . 0.0 112.151 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.8 m -114.59 143.2 45.37 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.14 0.576 . . . . 0.0 110.698 -0.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.787 ' HB3' HD11 ' A' ' 85' ' ' LEU . 11.4 m95 -133.08 -168.79 2.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.786 -179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.438 ' O ' ' CD2' ' A' ' 86' ' ' PHE . 30.7 t-80 -178.69 94.83 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.3 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.698 ' HB2' HD13 ' A' ' 85' ' ' LEU . 52.4 t -98.07 148.26 23.7 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.862 0.363 . . . . 0.0 111.71 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.663 ' O ' HG23 ' A' ' 83' ' ' ILE . 5.7 mm -108.44 150.25 11.23 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.423 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.337 179.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 50.2 t -134.74 76.83 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.112 179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -179.04 -69.77 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.622 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.89 ' HA ' ' HB3' ' A' ' 82' ' ' ALA . 11.2 mtp-105 -152.4 -44.1 0.1 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.541 0.21 . . . . 0.0 111.487 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.624 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 157.61 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.165 179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.552 ' N ' HD22 ' A' ' 61' ' ' ASN . 11.7 p90 -33.36 -36.08 0.03 OUTLIER 'General case' 0 C--O 1.232 0.143 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.502 ' HA3' HD12 ' A' ' 57' ' ' ILE . . . -61.26 -62.33 5.97 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.354 -179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.6 m 59.85 75.89 0.38 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.756 0.312 . . . . 0.0 111.086 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.447 ' HB2' ' CD2' ' A' ' 86' ' ' PHE . 13.9 m-85 -133.33 49.94 2.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.243 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.894 HG13 ' HB3' ' A' ' 73' ' ' PHE . 58.4 t -91.96 -73.62 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.857 0.36 . . . . 0.0 110.749 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 91.3 m -59.3 -30.12 68.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.323 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -54.38 -24.26 18.9 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.153 0.501 . . . . 0.0 109.683 178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.565 ' HB3' ' CA ' ' A' ' 88' ' ' SER . 2.6 mm-40 -91.03 -76.58 0.44 Allowed 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.095 179.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.848 HG22 ' HA ' ' A' ' 88' ' ' SER . 2.0 t -172.01 -99.05 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.521 179.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.786 ' H ' HG23 ' A' ' 70' ' ' THR . 0.0 OUTLIER -146.88 26.53 1.11 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.813 0.34 . . . . 0.0 110.617 179.269 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 87' ' ' LYS . 49.9 m170 -118.42 74.45 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.481 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.894 ' HB3' HG13 ' A' ' 66' ' ' VAL . 27.7 p90 -110.4 178.17 4.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.004 -179.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.608 HG13 ' HB1' ' A' ' 11' ' ' ALA . 4.8 tt -166.85 130.44 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.219 178.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.786 ' CE2' HD13 ' A' ' 84' ' ' LEU . 4.2 m-85 -119.25 153.54 34.85 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.914 0.388 . . . . 0.0 111.513 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 2.9 p90 -170.09 111.08 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.792 178.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.42 ' CG ' ' O ' ' A' ' 81' ' ' VAL . 9.4 t80 -86.02 130.64 34.47 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.28 -179.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.471 ' CD1' ' HB3' ' A' ' 25' ' ' ALA . 83.0 mt -134.71 137.41 43.5 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -178.737 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 32.91 60.54 0.41 Allowed Glycine 0 CA--C 1.523 0.539 0 N-CA-C 115.418 0.927 . . . . 0.0 115.418 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.483 ' N ' ' CD ' ' A' ' 80' ' ' GLN . 2.3 mp0 67.56 28.34 7.55 Favored 'General case' 0 CA--C 1.513 -0.474 0 CA-C-O 121.165 0.507 . . . . 0.0 110.367 178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HB ' ' O ' ' A' ' 78' ' ' LEU . 43.6 t -136.88 152.69 28.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.324 179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.89 ' HB3' ' HA ' ' A' ' 60' ' ' ARG . . . -120.26 110.19 16.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.943 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 57' ' ' ILE . 64.3 mt -113.76 132.99 61.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.086 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.786 HD13 ' CE2' ' A' ' 75' ' ' TYR . 0.5 OUTLIER -143.35 124.99 14.91 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.05 0.453 . . . . 0.0 111.384 -179.288 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.787 HD11 ' HB3' ' A' ' 54' ' ' TRP . 24.8 tp -107.27 146.18 31.8 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.534 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CD1' HG22 ' A' ' 66' ' ' VAL . 1.3 m-85 -130.17 157.48 42.33 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.548 -179.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.636 ' HD3' ' N ' ' A' ' 88' ' ' SER . 10.7 tmtt? -138.62 130.17 27.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.261 -178.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.848 ' HA ' HG22 ' A' ' 70' ' ' THR . 37.1 t -104.85 152.12 23.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.131 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.477 179.769 . . . . . . . . 0 0 . 1 stop_ save_