data_1urf_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 1urf _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.921 0.391 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 84.3 t -61.2 -45.7 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.58 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.98 -43.88 97.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.47 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.697 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -60.85 -50.67 65.01 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.01 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.595 ' HB3' HD23 ' A' ' 184' ' ' LEU . 93.4 mt -67.26 -40.2 86.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.82 0.343 . . . . 0.0 111.427 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -62.67 -47.15 84.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.575 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.697 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 65.8 pttt -60.85 -41.64 96.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.598 0.237 . . . . 0.0 111.116 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.7 mm-40 -57.42 -44.66 84.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.901 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.31 -41.83 97.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.403 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.46 -45.71 90.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.23 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.2 -41.32 83.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.908 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.73 ' HB3' HD12 ' A' ' 177' ' ' ILE . 62.1 mm-40 -57.95 -44.28 86.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.015 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.5 mt -61.3 -39.5 90.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.225 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -62.2 -47.84 82.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.562 HG13 ' OG ' ' A' ' 173' ' ' SER . 33.5 t -72.53 -48.31 47.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.0 tttp -60.29 -54.98 39.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.158 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -61.79 -38.8 89.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.34 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.558 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.95 -40.83 98.97 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.504 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.98 -42.11 81.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 110.568 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 49.7 mt-10 -62.5 -42.32 99.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.501 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 45.2 t30 -60.61 -40.18 90.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.776 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.3 mmm -67.93 -45.25 74.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.021 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.6 mt -57.09 -49.72 78.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.659 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.501 ' NE2' ' HA ' ' A' ' 147' ' ' ASN . 15.1 pt20 -63.59 -41.33 98.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.411 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 95.1 m -60.14 -44.5 94.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.535 ' CE2' ' HB3' ' A' ' 162' ' ' LEU . 7.3 m-30 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . 0.52 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 39.4 ttpt . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.976 0.417 . . . . 0.0 110.571 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.535 ' HB3' ' CE2' ' A' ' 152' ' ' TYR . 4.5 mm? -67.02 -34.82 78.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.108 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.0 tp -56.13 -54.18 48.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.381 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 161' ' ' LYS . 4.3 pp -64.29 -38.49 91.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.782 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.9 m -55.63 -46.02 77.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.961 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.61 94.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 73.7 mt-30 -56.35 -46.42 79.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.572 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -62.55 -41.15 98.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.044 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.409 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 73.5 mtp -57.44 -47.94 80.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.098 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 3.3 tm? -61.44 -44.17 97.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.624 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.895 ' HA ' ' HE3' ' A' ' 174' ' ' LYS . 85.7 mt-30 -59.07 -49.49 77.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -66.98 -41.09 87.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.784 0.326 . . . . 0.0 111.321 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.607 ' O ' HG13 ' A' ' 177' ' ' ILE . 58.2 m -62.42 -50.84 69.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.026 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.895 ' HE3' ' HA ' ' A' ' 171' ' ' GLN . 22.0 pttp -60.29 -40.09 89.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.507 ' O ' HG13 ' A' ' 179' ' ' ILE . 85.0 m -58.18 -47.55 83.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.045 0.45 . . . . 0.0 111.057 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.04 -34.9 77.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.73 HD12 ' HB3' ' A' ' 138' ' ' GLU . 21.7 mt -60.66 -49.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.713 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -59.94 -36.43 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 110.227 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 175' ' ' THR . 61.4 mt -61.96 -48.37 88.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 134' ' ' GLN . 68.0 mt -61.93 -41.08 89.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -55.31 -43.86 75.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.444 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.7 ttm -60.91 -41.04 95.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.185 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -59.23 -40.67 86.61 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.595 HD23 ' HB3' ' A' ' 131' ' ' LEU . 11.9 mt -58.23 -54.67 44.32 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.712 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.401 ' HG2' HH11 ' A' ' 185' ' ' ARG . 47.9 mtp85 -54.75 -41.98 71.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.39 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.41 HH11 ' HG2' ' A' ' 186' ' ' ARG . 53.7 ttt-85 -62.8 -34.65 77.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.712 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.128 -179.909 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.435 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 99.8 mtt180 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.737 0.303 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.495 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.3 t -56.98 -51.87 63.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.375 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.25 -40.79 97.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.114 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.81 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -61.39 -43.97 98.65 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.522 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.762 HD11 HD12 ' A' ' 184' ' ' LEU . 93.3 mt -67.5 -41.18 84.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.779 0.323 . . . . 0.0 111.197 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.2 mm-40 -63.73 -48.58 76.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.77 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.81 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 64.9 pttt -59.53 -41.53 90.23 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.014 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.628 ' HB3' HD12 ' A' ' 180' ' ' ILE . 12.9 mm100 -61.67 -39.33 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.958 0.409 . . . . 0.0 110.686 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.564 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.6 tm? -58.95 -41.74 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.392 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.92 89.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.157 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.39 -48.04 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.194 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 12.2 pt-20 -59.1 -45.4 90.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.375 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.98 -39.04 90.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.626 0.251 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -60.45 -44.29 95.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.209 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -66.26 -46.97 85.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.577 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.557 ' HB2' ' HG ' ' A' ' 173' ' ' SER . 40.3 ttmt -61.63 -46.81 88.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.276 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -62.69 -48.91 77.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.641 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.507 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.55 -34.62 86.63 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.753 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.604 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.87 -44.64 76.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.873 0.368 . . . . 0.0 110.348 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 51.7 mt-10 -60.15 -41.78 93.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.87 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 20.1 t-20 -59.04 -43.77 91.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.341 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.517 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.8 mmm -67.5 -45.37 76.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.6 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.604 HG13 ' O ' ' A' ' 145' ' ' ALA . 89.6 mt -52.88 -53.77 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.407 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 147' ' ' ASN . 3.0 pt20 -58.99 -36.55 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.033 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 54.9 m -54.93 -54.96 36.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.862 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.517 ' HD1' ' O ' ' A' ' 148' ' ' MET . 37.1 m-85 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.642 -179.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.036 0.446 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 98.8 mt -61.02 -36.39 79.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.004 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 39.9 tp -57.37 -46.42 83.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.104 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.54 -42.75 75.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.417 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.562 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.7 m -57.19 -42.74 81.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.819 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -71.0 -35.83 72.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.297 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 13.0 mm-40 -56.92 -48.82 77.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.991 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 165' ' ' THR . 19.4 pt20 -65.45 -41.37 93.49 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.162 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.562 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.8 mtm -59.51 -38.18 80.26 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-O 120.865 0.364 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.476 ' C ' HD11 ' A' ' 170' ' ' LEU . 3.3 tm? -61.6 -45.43 94.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -59.8 -50.85 72.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.17 -39.55 93.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.557 ' HG ' ' HB2' ' A' ' 142' ' ' LYS . 43.1 t -56.86 -44.75 82.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.82 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.444 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 55.9 mtpt -61.06 -44.54 97.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.625 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -56.03 -41.69 75.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.88 -45.52 93.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.05 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.556 HD13 ' HE3' ' A' ' 142' ' ' LYS . 28.5 mt -57.85 -41.78 80.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.942 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.59 -49.31 73.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.754 0.311 . . . . 0.0 111.435 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 64.6 mt -62.12 -50.29 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.32 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.628 HD12 ' HB3' ' A' ' 134' ' ' GLN . 70.5 mt -59.13 -43.97 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -53.55 -41.09 66.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.273 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.426 ' SD ' ' HD3' ' A' ' 185' ' ' ARG . 48.0 tpp -62.62 -38.24 89.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.306 179.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.69 -44.09 94.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.259 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.762 HD12 HD11 ' A' ' 131' ' ' LEU . 4.3 mm? -58.36 -55.27 37.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.426 ' HD3' ' SD ' ' A' ' 182' ' ' MET . 16.0 ptm180 -58.85 -38.63 79.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.727 0.299 . . . . 0.0 110.594 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.502 ' O ' ' HD3' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -57.74 -40.45 79.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.739 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.867 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.487 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 6.5 tpm_? . . . . . 0 CA--C 1.529 0.152 0 CA-C-O 120.641 0.258 . . . . 0.0 111.511 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 89.6 t -63.53 -52.57 56.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.898 0.38 . . . . 0.0 111.54 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.77 85.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.505 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.41 -44.42 97.64 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.572 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.728 ' HB3' HD23 ' A' ' 184' ' ' LEU . 94.8 mt -67.88 -41.0 83.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.851 0.358 . . . . 0.0 111.074 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 95.3 mt-10 -64.18 -49.19 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.537 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.458 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -57.2 -39.48 75.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.765 0.317 . . . . 0.0 110.608 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.548 ' HB3' HD12 ' A' ' 180' ' ' ILE . 95.0 mm-40 -58.29 -46.07 86.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.562 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 95.5 mt -54.62 -44.48 73.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.03 99.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.345 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.9 mt -59.74 -48.82 86.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.317 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.416 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.0 OUTLIER -55.67 -45.38 77.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.694 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 48.0 mt -62.35 -38.51 89.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -63.01 -42.81 99.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 0.0 110.479 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.69 -46.36 82.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.208 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.711 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 38.9 ttmt -61.01 -49.47 77.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -62.34 -43.55 98.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.449 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.472 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.68 -36.26 89.03 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.883 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.527 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.17 -41.77 80.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.96 0.409 . . . . 0.0 110.568 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.4 mt-10 -60.06 -44.57 94.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.999 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.541 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 19.3 t-20 -61.8 -44.86 96.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.554 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.5 mtp -61.0 -40.76 94.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 145' ' ' ALA . 85.3 mt -61.21 -51.07 77.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 147' ' ' ASN . 4.0 pp0? -66.85 -30.47 70.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.713 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.7 m -64.59 -50.61 66.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.86 179.807 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 8.4 ptpp? . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.751 0.31 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.95 -35.92 72.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.819 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -57.03 -51.26 69.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.094 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 161' ' ' LYS . 4.2 pp -65.03 -38.52 91.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.7 m -55.63 -45.19 77.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.46 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -63.71 -40.68 97.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.325 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.6 mt-30 -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.934 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -60.69 -41.28 94.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.96 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.411 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 71.6 mtp -59.71 -47.48 85.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.477 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.545 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 60.7 tp -57.03 -44.47 82.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.553 ' HA ' ' NZ ' ' A' ' 174' ' ' LYS . 8.3 tt0 -61.64 -43.14 99.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.081 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.41 -43.93 96.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.417 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 177' ' ' ILE . 89.3 p -62.29 -45.58 92.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.435 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.711 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 10.4 mtmp? -57.66 -49.64 75.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.6 m -55.73 -43.34 76.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.282 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.93 -41.01 97.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.072 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 173' ' ' SER . 64.1 mt -58.48 -41.07 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.025 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.6 -46.15 83.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.184 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.562 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 51.0 mm -62.93 -43.87 99.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.08 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.548 HD12 ' HB3' ' A' ' 134' ' ' GLN . 72.9 mt -65.64 -40.73 88.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 110.501 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.471 ' HE ' ' NH2' ' A' ' 185' ' ' ARG . 78.4 ttt180 -52.06 -52.11 53.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.393 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 21.2 ptp -62.79 -39.77 95.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.562 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 86.4 mt-30 -55.27 -43.88 75.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.717 0.294 . . . . 0.0 110.483 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.728 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.4 mm? -61.53 -39.28 90.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.471 ' NH2' ' HE ' ' A' ' 181' ' ' ARG . 21.5 mmt85 -55.85 -58.16 9.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.417 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.428 HH11 ' HG2' ' A' ' 186' ' ' ARG . 0.6 OUTLIER -67.23 -32.78 74.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.406 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 183' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 111.044 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.445 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 15.5 tpp85 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.717 0.294 . . . . 0.0 111.316 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.441 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.1 t -61.85 -54.85 29.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.363 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.83 -38.07 86.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.104 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.583 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.23 -45.27 96.38 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.524 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.744 ' HB3' HD23 ' A' ' 184' ' ' LEU . 93.3 mt -67.88 -43.9 78.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.709 0.29 . . . . 0.0 111.155 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 58.4 mm-40 -60.11 -48.27 82.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.672 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -60.19 -40.81 91.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.179 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.8 mm100 -56.68 -45.01 82.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.692 0.282 . . . . 0.0 110.923 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.9 tp -60.12 -42.73 95.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.893 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.74 96.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.8 mt -59.47 -42.3 87.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.689 ' HB3' HD12 ' A' ' 177' ' ' ILE . 4.8 mm-40 -58.59 -43.98 89.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.42 ' HA ' HD21 ' A' ' 139' ' ' LEU . 94.2 mt -60.11 -38.26 82.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.486 ' C ' ' HD3' ' A' ' 140' ' ' LYS . 13.0 tmtt? -63.59 -52.85 59.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.228 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.1 -45.27 87.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.748 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.431 ' HG3' HD13 ' A' ' 170' ' ' LEU . 62.8 tttm -58.05 -45.77 86.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.056 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -64.06 -47.91 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.195 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.31 -32.16 79.8 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.822 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.633 ' O ' HG12 ' A' ' 149' ' ' ILE . . . -66.17 -43.99 85.32 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.105 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.6 mt-10 -58.96 -40.83 85.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.343 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -58.5 -42.63 88.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.536 ' HE3' ' HB1' ' A' ' 166' ' ' ALA . 83.5 mtp -66.4 -45.85 78.6 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.604 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.633 HG12 ' O ' ' A' ' 145' ' ' ALA . 43.0 mm -54.65 -42.91 63.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.688 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -41.78 65.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 67.2 m -56.71 -52.86 63.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.86 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.942 -179.225 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.794 0.33 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.07 -35.61 74.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.112 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.1 tp -54.66 -49.2 71.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.858 0.361 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.9 mt -67.04 -35.8 80.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.38 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.6 m -57.59 -47.85 81.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.257 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . 0.536 ' HB1' ' HE3' ' A' ' 148' ' ' MET . . . -66.56 -46.54 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.089 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 85.4 mt-30 -56.8 -36.99 70.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.154 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.2 tp60 -64.24 -44.24 92.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.821 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 165' ' ' THR . 39.1 mtm -63.2 -42.39 99.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.424 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.559 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 49.1 tp -61.22 -46.23 91.3 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -61.09 -44.5 97.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.287 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -57.74 -43.26 85.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.848 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.555 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.0 m -63.13 -43.32 98.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.061 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.4 mmmm -56.07 -51.91 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.516 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.3 m -56.41 -45.87 80.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.679 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.403 ' O ' HG13 ' A' ' 180' ' ' ILE . 34.4 mmtp -62.84 -41.81 99.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.487 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.689 HD12 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -59.99 -40.16 82.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.355 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.6 -46.06 90.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.669 ' O ' ' HG3' ' A' ' 182' ' ' MET . 67.0 mt -63.22 -44.15 99.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.928 0.394 . . . . 0.0 110.761 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.484 HG21 HD22 ' A' ' 184' ' ' LEU . 69.7 mt -63.99 -38.2 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.897 0.38 . . . . 0.0 110.369 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.427 ' HG3' HH11 ' A' ' 181' ' ' ARG . 40.3 ttt85 -54.93 -49.27 71.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.251 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.669 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 4.5 ppp? -65.54 -32.9 74.74 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.559 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 73.3 mt-30 -61.03 -47.25 87.28 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.851 0.357 . . . . 0.0 110.576 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.744 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -60.19 -43.92 95.5 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.669 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 48.3 mtp85 -54.44 -44.19 72.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.601 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -63.79 -36.21 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.917 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.018 -179.923 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.44 ' O ' HD11 ' A' ' 131' ' ' LEU . 55.1 ttp85 . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.779 0.323 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 72.6 t -47.51 -48.71 10.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.532 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.06 -37.23 81.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.56 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -60.2 -58.18 15.34 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.538 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 184' ' ' LEU . 7.0 mp -53.25 -43.31 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.681 0.277 . . . . 0.0 111.71 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.3 mt-10 -64.36 -50.53 67.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 23.2 pttm -59.94 -37.92 80.92 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.1 mm100 -59.22 -48.79 80.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.296 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.597 HD22 HG22 ' A' ' 180' ' ' ILE . 88.0 mt -57.64 -44.14 85.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.636 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.453 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -60.93 -49.7 76.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.056 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.83 -48.75 86.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.963 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -45.4 91.45 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 86.7 mt -58.66 -41.47 86.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 62.1 mttp -61.81 -49.71 75.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.378 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.36 -46.67 83.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 111.382 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.8 tttt -57.25 -47.35 81.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.051 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -59.07 -42.65 90.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.04 -37.65 94.9 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.188 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.415 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.27 -41.17 90.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.1 0.476 . . . . 0.0 110.243 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -63.33 -39.35 94.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.44 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.32 -44.61 88.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.428 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 18.7 mmt -63.64 -48.33 77.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.142 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.575 HD13 HD21 ' A' ' 170' ' ' LEU . 69.6 mt -55.19 -45.43 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 0.0 111.086 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.99 -39.7 90.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.091 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.5 m -65.37 -52.32 54.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.708 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.428 ' HD1' ' O ' ' A' ' 148' ' ' MET . 10.0 m-85 . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.608 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.2 tptt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.708 0.29 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.195 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.414 ' HG ' HE21 ' A' ' 167' ' ' GLN . 63.3 tp -55.66 -52.55 63.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.886 0.374 . . . . 0.0 110.464 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 87.3 mt -69.56 -37.14 76.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.491 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.44 ' O ' ' HG3' ' A' ' 169' ' ' MET . 94.6 m -55.52 -44.66 76.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.841 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . 0.403 ' HA ' ' HE1' ' A' ' 169' ' ' MET . . . -65.95 -44.49 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.564 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.414 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.3 mt-30 -58.29 -38.11 76.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.149 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 94.5 mm-40 -63.62 -42.72 98.15 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.037 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.44 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.6 mtm -64.17 -40.43 96.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.575 HD21 HD13 ' A' ' 149' ' ' ILE . 49.3 tp -62.55 -42.88 99.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.984 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -58.79 -45.39 89.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.767 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -60.61 -41.46 94.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.727 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.45 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.7 m -62.05 -42.35 99.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.945 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.7 mtpp -57.91 -44.38 86.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.004 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 92.2 m -61.0 -46.11 92.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.0 mtpp -59.89 -47.87 84.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.853 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.464 HG23 ' NH1' ' A' ' 181' ' ' ARG . 64.7 mt -60.23 -35.77 64.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.962 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . 0.569 ' HA ' ' CZ ' ' A' ' 181' ' ' ARG . 30.4 t70 -57.72 -49.41 76.63 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.404 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 42.3 mm -60.65 -39.29 81.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.4 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.597 HG22 HD22 ' A' ' 135' ' ' LEU . 66.2 mt -56.39 -53.67 37.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.569 ' CZ ' ' HA ' ' A' ' 178' ' ' ASP . 78.3 mtm-85 -52.38 -39.38 60.74 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.487 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 64.9 mtt -57.87 -40.2 79.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.434 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.4 ' C ' HD22 ' A' ' 131' ' ' LEU . 86.1 mt-30 -70.37 -41.74 72.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.222 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.488 HD21 HD22 ' A' ' 131' ' ' LEU . 4.4 mm? -61.11 -51.71 67.94 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.504 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 16.9 ptm180 -59.29 -45.09 92.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -63.72 -35.75 81.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.098 0.475 . . . . 0.0 110.565 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . 0.429 ' HB2' ' NH1' ' A' ' 127' ' ' ARG . . . . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.324 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' A' ' 127' ' ' ARG . 62.2 mtm-85 . . . . . 0 C--O 1.231 0.128 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.444 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 96.2 t -65.34 -48.82 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.294 . . . . 0.0 111.773 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.6 83.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.325 -179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.578 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.58 -46.03 95.12 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.535 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.61 -43.67 88.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.828 0.347 . . . . 0.0 111.093 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -60.64 -50.84 71.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.867 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 22.1 ptmt -57.93 -38.82 76.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.559 0.218 . . . . 0.0 110.907 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.0 mm-40 -57.92 -45.33 86.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.803 0.335 . . . . 0.0 110.66 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.503 ' HA ' ' CD ' ' A' ' 138' ' ' GLU . 60.5 tp -60.27 -38.34 83.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.271 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.6 80.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.07 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.8 mt -64.57 -49.09 82.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.664 ' OE1' HG13 ' A' ' 180' ' ' ILE . 7.6 pt-20 -57.89 -44.8 86.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.1 mt -59.89 -42.17 93.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.752 0.311 . . . . 0.0 110.943 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -59.39 -45.26 91.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.02 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.3 t -65.86 -45.94 90.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.667 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.649 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 40.2 ttmt -60.16 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.679 0.276 . . . . 0.0 111.107 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.31 -43.4 98.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.856 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.2 -37.86 94.68 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.335 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.37 -42.88 82.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 110.417 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.48 -41.22 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.736 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -58.07 -45.66 86.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.613 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 92.0 mmm -65.6 -46.04 80.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 145' ' ' ALA . 87.4 mt -55.79 -46.24 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.181 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 72.9 mt-30 -62.16 -41.2 98.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.0 m -64.79 -37.74 88.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.584 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.109 -179.311 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . 0.613 ' NZ ' ' HB2' ' A' ' 161' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.209 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.425 ' N ' ' HG3' ' A' ' 161' ' ' LYS . 60.7 tp -59.8 -43.41 94.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.494 0.188 . . . . 0.0 111.104 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.425 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 61.3 tp -59.11 -40.4 85.23 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.79 -42.71 72.11 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.065 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 93.2 m -57.42 -46.02 83.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.262 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.15 94.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.797 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 96.8 mm-40 -57.27 -47.27 81.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.407 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.42 -38.33 89.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.021 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 69.0 mmm -59.92 -46.52 89.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.284 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 3.4 tm? -56.48 -46.97 80.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.539 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -62.88 -42.64 99.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.917 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 48.7 m -58.22 -43.94 87.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.113 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.649 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 7.5 mtpm? -59.2 -44.22 92.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.739 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.9 m -57.49 -43.53 84.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.57 ' NZ ' ' HB3' ' A' ' 176' ' ' LYS . 7.9 mtpm? -56.99 -49.68 75.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.722 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.53 HD13 ' NZ ' ' A' ' 142' ' ' LYS . 56.4 mt -57.9 -41.08 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.184 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.09 -45.96 89.52 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.889 0.376 . . . . 0.0 110.586 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 51.2 mm -58.53 -39.68 76.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.384 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.664 HG13 ' OE1' ' A' ' 138' ' ' GLU . 46.9 mm -60.68 -47.32 93.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.855 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.484 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.0 tpt85 -52.9 -42.13 65.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.186 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -60.93 -42.32 97.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.554 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -61.1 -46.11 91.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.614 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.445 ' N ' HD21 ' A' ' 184' ' ' LEU . 4.4 mm? -57.84 -42.27 84.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.868 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 51.2 mtp85 -59.9 -46.37 89.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.879 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.401 HH11 ' HG2' ' A' ' 186' ' ' ARG . 47.6 mtp85 -60.93 -37.76 83.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.083 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.689 0.281 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.502 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 82.7 t -61.03 -57.15 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.6 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.73 90.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.562 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.828 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -61.16 -47.67 89.84 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.909 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.546 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 82.8 mt -67.51 -41.34 84.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.666 0.27 . . . . 0.0 111.535 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -61.76 -47.65 84.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.776 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.828 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 64.8 pttt -60.08 -42.35 94.43 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.81 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.7 mm-40 -61.04 -40.5 93.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.816 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 3.4 tm? -58.62 -46.42 87.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.248 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.505 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -66.79 -45.95 76.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.07 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.513 ' O ' HG22 ' A' ' 141' ' ' VAL . 71.2 mt -60.96 -48.62 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.478 ' CG ' HG12 ' A' ' 177' ' ' ILE . 24.3 pt-20 -59.78 -43.82 94.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.522 HD21 HD12 ' A' ' 177' ' ' ILE . 84.0 mt -59.29 -45.16 92.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.684 0.278 . . . . 0.0 110.984 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.632 ' HB3' ' HZ2' ' A' ' 140' ' ' LYS . 8.1 mtpm? -59.73 -42.91 94.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.933 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 137' ' ' ILE . 59.6 t -62.41 -40.55 88.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.734 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.547 ' HG3' HD13 ' A' ' 170' ' ' LEU . 86.3 tttt -61.35 -49.04 78.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.97 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -61.43 -44.39 97.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.516 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.17 -38.42 95.58 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.638 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.51 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.47 -41.51 84.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.976 0.417 . . . . 0.0 110.765 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 96.2 mt-10 -59.53 -44.14 93.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.021 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.85 -44.42 97.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.547 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.516 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 91.9 mmm -64.3 -42.7 96.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.238 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 167' ' ' GLN . 88.8 mt -62.63 -47.78 91.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 84.6 mt-30 -63.52 -44.94 92.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.182 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 94.5 m -62.5 -49.43 75.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.68 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.502 ' CE1' ' HE2' ' A' ' 148' ' ' MET . 2.7 m-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.691 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . 0.411 ' HZ3' ' HG ' ' A' ' 162' ' ' LEU . 22.0 pttp . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.77 0.319 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.411 ' HG ' ' HZ3' ' A' ' 161' ' ' LYS . 90.7 mt -64.53 -37.68 88.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.368 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 62.8 tp -58.51 -42.66 88.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.43 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 85.1 mt -63.05 -38.73 92.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.402 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.442 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.0 m -65.43 -41.74 93.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.888 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.91 -48.63 70.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.597 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.526 ' HA ' HD12 ' A' ' 149' ' ' ILE . 3.2 pt20 -58.24 -38.57 77.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.077 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -63.09 -39.98 96.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.827 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 165' ' ' THR . 68.5 mtp -61.58 -46.33 90.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.813 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' A' ' 142' ' ' LYS . 56.2 tp -57.02 -46.1 82.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.286 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -60.87 -46.8 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.22 -42.42 98.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.539 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.6 m -62.86 -49.74 73.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.429 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.9 mtpp -57.14 -43.24 82.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.011 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.432 ' O ' HD11 ' A' ' 179' ' ' ILE . 91.1 m -59.01 -47.42 85.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.94 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.3 -40.21 81.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 173' ' ' SER . 53.0 mt -59.74 -39.78 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -62.47 -53.13 59.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.279 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.432 HD11 ' O ' ' A' ' 175' ' ' THR . 2.0 mp -62.48 -56.15 19.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.084 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.557 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 68.0 mt -52.7 -40.24 33.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.627 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.482 ' HA ' ' HG ' ' A' ' 184' ' ' LEU . 15.6 tpp85 -54.77 -43.95 73.23 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.984 0.421 . . . . 0.0 110.081 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.41 ' HE1' ' HB3' ' A' ' 182' ' ' MET . 91.2 mmm -57.32 -43.7 83.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.458 179.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.41 ' HB3' HD23 ' A' ' 131' ' ' LEU . 9.8 mp0 -67.32 -32.27 73.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.276 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 180' ' ' ILE . 20.7 mt -57.09 -57.13 13.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.252 0.549 . . . . 0.0 110.663 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -62.6 -41.57 99.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' A' ' 186' ' ' ARG . 4.7 tmm_? -59.22 -40.27 85.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.565 -179.705 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.554 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 5.5 tpm_? . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.745 0.307 . . . . 0.0 111.475 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.2 t -65.49 -51.51 62.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.51 93.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.921 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.572 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.79 -49.67 66.7 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.827 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.422 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 98.1 mt -65.74 -44.85 84.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.831 0.348 . . . . 0.0 111.083 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -56.81 -50.8 71.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.627 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 15.0 ptmm? -58.71 -36.63 74.56 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.414 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.699 ' HB3' HD12 ' A' ' 180' ' ' ILE . 3.5 mm100 -56.2 -45.22 79.9 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.509 179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.441 HD11 ' OE2' ' A' ' 138' ' ' GLU . 4.5 mm? -58.74 -41.18 85.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.065 0.46 . . . . 0.0 110.485 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.1 89.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.935 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.7 mt -66.46 -49.53 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.127 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.639 ' OE1' HD12 ' A' ' 177' ' ' ILE . 1.4 pp20? -60.19 -43.32 96.0 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.464 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.495 ' HG ' ' OE2' ' A' ' 138' ' ' GLU . 93.1 mt -56.54 -45.31 81.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.82 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -62.39 -47.06 85.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.4 ' O ' ' HB1' ' A' ' 145' ' ' ALA . 61.5 t -64.93 -40.83 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.424 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 61.8 tttm -62.21 -50.21 72.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.173 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.01 -44.89 91.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.763 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.456 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -63.15 -34.78 90.89 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.534 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.07 -42.48 80.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.952 0.406 . . . . 0.0 110.799 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.4 mt-10 -60.7 -43.59 97.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -60.99 -41.36 96.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.456 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.2 mtp -64.66 -44.3 90.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 79.9 mt -58.64 -50.29 79.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.544 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -65.48 -39.97 92.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.502 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.8 m -57.4 -49.33 76.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.779 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.554 ' HB2' HD12 ' A' ' 163' ' ' LEU . 4.2 m-85 . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.708 0.29 . . . . 0.0 111.355 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.729 0.3 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.441 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 98.2 mt -62.91 -38.3 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.255 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' ' 152' ' ' TYR . 54.5 tp -58.12 -43.4 87.18 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.51 -42.49 92.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.529 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.7 m -59.06 -43.04 91.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.944 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.01 -44.16 97.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.441 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -57.74 -43.23 85.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.398 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -60.51 -38.02 83.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.048 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.446 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 70.6 mtp -62.11 -47.22 85.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.848 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.455 ' HB2' ' HB2' ' A' ' 145' ' ' ALA . 3.4 tm? -57.8 -48.55 79.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.006 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.423 HE21 ' HB3' ' A' ' 171' ' ' GLN . 0.0 OUTLIER -62.43 -43.53 98.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.013 -179.629 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . 0.549 ' OD1' ' HE2' ' A' ' 176' ' ' LYS . 8.7 t70 -61.29 -43.58 98.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.092 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 177' ' ' ILE . 38.8 t -59.72 -46.17 89.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -57.93 -40.31 80.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 88.7 m -58.62 -45.93 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.549 ' HE2' ' OD1' ' A' ' 172' ' ' ASP . 68.0 mttm -61.07 -43.81 98.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.639 HD12 ' OE1' ' A' ' 138' ' ' GLU . 63.0 mt -55.61 -40.87 61.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.355 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -64.97 -48.62 73.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.073 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 43.4 mm -61.73 -47.19 94.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.699 HD12 ' HB3' ' A' ' 134' ' ' GLN . 74.8 mt -61.82 -40.58 87.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.001 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 181' ' ' ARG . 41.5 ttt85 -55.18 -44.75 75.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 43.9 tpp -61.23 -39.98 92.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.154 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -59.66 -41.01 89.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.709 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.422 ' CD2' ' HB3' ' A' ' 131' ' ' LEU . 8.2 mt -59.31 -43.99 92.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.226 0.536 . . . . 0.0 109.954 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.587 ' HA ' HH11 ' A' ' 185' ' ' ARG . 3.3 mmm180 -56.6 -41.87 77.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.218 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.95 -39.39 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.716 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.018 -179.926 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.554 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 4.0 mmp_? . . . . . 0 N--CA 1.461 0.107 0 CA-C-O 120.707 0.289 . . . . 0.0 111.537 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.474 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 59.8 t -58.64 -46.21 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.61 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.72 92.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.702 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.724 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -65.62 -44.98 91.68 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.117 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.738 HD11 HD12 ' A' ' 184' ' ' LEU . 92.4 mt -65.61 -43.22 90.3 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.744 -0.268 . . . . 0.0 111.474 -179.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.8 mm-40 -64.39 -46.61 82.58 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.724 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 66.0 pttt -57.83 -41.12 81.65 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.771 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 13.2 mm100 -59.46 -43.27 93.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.692 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.43 -43.82 96.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.88 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.3 84.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.485 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.1 -40.93 76.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.59 ' HB3' HD12 ' A' ' 177' ' ' ILE . 63.2 mm-40 -61.67 -42.1 98.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.0 mt -59.16 -42.83 91.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.292 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.07 -47.75 83.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.732 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . 0.496 HG13 ' HG ' ' A' ' 173' ' ' SER . 38.7 t -71.28 -48.77 52.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -60.88 -52.21 66.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.5 -179.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.21 -46.44 88.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.832 0.349 . . . . 0.0 110.752 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.581 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -62.34 -34.84 90.52 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.149 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.561 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.89 -40.3 91.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.937 0.399 . . . . 0.0 110.211 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -59.84 -42.08 92.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.32 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.581 HD21 ' HA3' ' A' ' 144' ' ' GLY . 76.7 m-20 -59.99 -42.12 93.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.201 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.5 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 89.1 mmm -64.46 -42.66 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.63 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.3 mt -60.69 -50.46 80.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.472 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -66.13 -42.52 89.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.761 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -49.53 77.21 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.55 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.2 m-85 . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.717 0.294 . . . . 0.0 111.706 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.776 0.322 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.55 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 97.2 mt -58.4 -39.02 78.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.437 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 30.8 tp -57.78 -46.86 83.98 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.068 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.432 ' HA ' HD21 ' A' ' 164' ' ' LEU . 93.2 mt -58.77 -41.72 87.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.938 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 86.8 m -61.12 -41.32 96.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.519 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.29 80.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.445 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -60.41 -45.47 93.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.133 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -62.5 -40.78 97.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.538 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.459 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.6 mmm -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.58 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 2.9 tm? -61.48 -44.32 97.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.3 -47.17 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.288 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 63.6 t0 -66.38 -40.95 90.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.191 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.5 m -62.12 -52.41 63.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.914 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.595 ' NZ ' ' HB2' ' A' ' 174' ' ' LYS . 0.0 OUTLIER -61.83 -41.65 98.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.506 -179.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 93.4 m -57.84 -48.53 79.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.795 0.331 . . . . 0.0 111.255 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.631 ' HB3' ' HZ3' ' A' ' 176' ' ' LYS . 4.0 mmmp? -58.98 -40.25 84.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.59 HD12 ' HB3' ' A' ' 138' ' ' GLU . 40.0 mt -59.91 -38.63 77.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -60.86 -45.04 96.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 110.009 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.472 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 56.9 mt -59.59 -49.05 85.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.361 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.593 HG23 HD22 ' A' ' 184' ' ' LEU . 70.5 mt -62.18 -36.42 74.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.606 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 185' ' ' ARG . 51.2 ttt-85 -52.39 -50.29 62.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.543 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 62.0 mtm -63.54 -38.75 92.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.871 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 24.5 mt-30 -56.72 -46.42 81.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.747 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.738 HD12 HD11 ' A' ' 131' ' ' LEU . 4.3 mm? -61.92 -42.12 98.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.002 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.479 ' NE ' ' HA ' ' A' ' 185' ' ' ARG . 3.7 mmp_? -52.42 -48.27 65.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.21 -35.32 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.459 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.789 0.328 . . . . 0.0 111.171 -179.74 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.401 ' HG2' HH11 ' A' ' 127' ' ' ARG . 54.2 ttp85 . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.858 0.361 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.25 -48.25 85.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.579 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -61.5 -45.64 93.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.701 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.572 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -57.98 -48.73 80.69 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.989 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.579 ' HB3' HD23 ' A' ' 184' ' ' LEU . 64.4 mt -68.34 -43.43 77.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.015 0.436 . . . . 0.0 111.05 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.75 -46.53 89.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 16.9 ptpt -61.71 -40.37 94.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.978 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -56.21 -45.83 79.72 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.8 0.333 . . . . 0.0 110.761 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.494 HD22 HG23 ' A' ' 180' ' ' ILE . 97.2 mt -58.91 -45.93 89.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.315 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.4 -47.76 80.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 133' ' ' LYS . 76.4 mt -56.56 -43.34 78.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.437 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.0 mm-40 -61.87 -41.79 98.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.158 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.2 mt -57.91 -39.95 79.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.859 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -62.69 -48.99 76.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.035 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 51.1 t -65.5 -42.49 93.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.574 ' HG3' HD23 ' A' ' 170' ' ' LEU . 61.8 tttm -59.69 -46.41 89.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.669 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -61.72 -47.23 86.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.493 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -59.97 -36.41 90.16 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.606 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.524 ' HB3' ' HB2' ' A' ' 170' ' ' LEU . . . -66.57 -41.52 88.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 110.501 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.627 ' HG2' HD22 ' A' ' 170' ' ' LEU . 58.2 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.675 179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.493 HD21 ' HA3' ' A' ' 144' ' ' GLY . 78.7 m-20 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.654 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.479 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.0 mtp -70.57 -48.93 52.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.222 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.2 mt -53.83 -47.29 63.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.361 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -66.69 -38.17 86.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.316 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 55.6 m -61.56 -51.37 68.84 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 163' ' ' LEU . 18.4 m-85 . . . . . 0 C--N 1.33 -0.264 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? . . . . . 0 C--O 1.233 0.186 0 CA-C-O 121.01 0.433 . . . . 0.0 110.11 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.11 -31.56 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.365 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 152' ' ' TYR . 51.2 tp -57.91 -48.78 78.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.635 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.92 -44.84 91.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.821 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.1 m -60.96 -41.21 95.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.01 95.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.902 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.502 HE21 ' HG ' ' A' ' 163' ' ' LEU . 73.3 mt-30 -59.45 -40.04 85.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.101 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.596 ' HA ' HE21 ' A' ' 171' ' ' GLN . 53.3 tt0 -61.03 -39.39 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.357 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.454 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 67.2 mtp -66.16 -45.63 80.25 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.086 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.627 HD22 ' HG2' ' A' ' 146' ' ' GLU . 2.9 tm? -57.38 -52.18 66.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.256 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.596 HE21 ' HA ' ' A' ' 168' ' ' GLN . 25.6 pt20 -64.18 -40.94 97.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.375 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -61.79 -44.13 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.898 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 177' ' ' ILE . 47.6 t -59.11 -45.57 90.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.046 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.69 -41.98 87.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.907 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.0 m -56.24 -47.13 79.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.969 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.526 ' O ' HG13 ' A' ' 180' ' ' ILE . 63.7 mttp -61.43 -39.8 92.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.56 ' O ' ' HG2' ' A' ' 181' ' ' ARG . 57.7 mt -62.72 -41.58 92.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.415 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -60.57 -51.44 69.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.368 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 34.1 pt -63.07 -40.02 87.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.512 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 176' ' ' LYS . 62.4 mt -60.22 -45.34 96.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.59 0.233 . . . . 0.0 110.824 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 26.1 mmm180 -56.2 -44.13 79.17 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.324 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.744 ' HG3' HH21 ' A' ' 185' ' ' ARG . 45.8 ttm -59.36 -40.23 85.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.412 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 99.3 mm-40 -60.75 -38.28 84.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.269 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.579 HD23 ' HB3' ' A' ' 131' ' ' LEU . 8.3 mt -60.34 -43.67 96.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.227 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.744 HH21 ' HG3' ' A' ' 182' ' ' MET . 72.6 mtm180 -56.8 -46.3 81.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.176 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -65.29 -38.87 91.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.949 179.804 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 29.7 tpt180 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.86 0.362 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.42 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 92.1 t -57.46 -53.3 45.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.347 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.83 -36.74 84.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.518 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -59.89 -43.8 97.71 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.341 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.618 ' HB3' HD13 ' A' ' 184' ' ' LEU . 77.5 mt -67.1 -41.6 86.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.89 0.376 . . . . 0.0 110.807 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -63.18 -49.63 73.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.591 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.44 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.36 -41.49 89.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.585 0.231 . . . . 0.0 110.922 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.1 mm-40 -58.61 -41.32 85.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 1.7 tm? -59.95 -43.97 94.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.641 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.84 71.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.968 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 133' ' ' LYS . 70.9 mt -58.5 -46.54 89.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.542 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.474 ' HB3' HD13 ' A' ' 177' ' ' ILE . 96.0 mt-10 -59.62 -45.32 92.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.79 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.535 ' HB3' HE21 ' A' ' 143' ' ' GLN . 70.6 mt -62.16 -33.57 74.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.341 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -58.67 -48.46 81.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.702 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.4 t -71.4 -42.21 73.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.17 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.538 ' NZ ' ' HD3' ' A' ' 174' ' ' LYS . 39.5 ttmt -58.67 -50.15 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.535 HE21 ' HB3' ' A' ' 139' ' ' LEU . 74.7 mt-30 -62.34 -42.98 99.83 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.649 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.532 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.24 -38.01 93.87 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.104 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.21 -40.94 86.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.97 0.414 . . . . 0.0 110.375 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.9 mt-10 -59.09 -44.6 91.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.268 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -39.84 91.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.798 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.0 mtp -64.57 -37.21 86.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.693 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 72.4 mt -64.62 -45.84 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.817 0.342 . . . . 0.0 111.042 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.61 -42.28 74.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.352 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 88.8 m -68.13 -48.54 65.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.656 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.437 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 1.3 m-85 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.67 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.731 0.3 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.437 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 91.8 mt -61.35 -39.89 92.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.556 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.66 -45.59 89.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.457 HD21 ' NE2' ' A' ' 167' ' ' GLN . 91.1 mt -59.45 -40.65 87.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.57 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -57.57 -42.95 84.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.753 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -60.43 -41.96 95.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.457 ' NE2' HD21 ' A' ' 164' ' ' LEU . 73.1 mt-30 -57.54 -43.06 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.319 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.755 ' HA ' HE21 ' A' ' 171' ' ' GLN . 41.1 tt0 -60.34 -40.57 91.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.126 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.766 ' HA ' ' HE1' ' A' ' 169' ' ' MET . 0.0 OUTLIER -60.74 -36.61 79.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.847 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.48 HD21 ' HA ' ' A' ' 170' ' ' LEU . 2.8 tm? -69.2 -45.81 68.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.707 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.755 HE21 ' HA ' ' A' ' 168' ' ' GLN . 24.6 pt20 -64.76 -45.96 84.15 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . 0.513 ' OD2' ' HA ' ' A' ' 169' ' ' MET . 3.0 p30 -64.42 -37.73 88.55 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.07 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.499 ' O ' HD11 ' A' ' 177' ' ' ILE . 90.3 p -62.76 -44.04 97.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.538 ' HD3' ' NZ ' ' A' ' 142' ' ' LYS . 74.9 mmtt -54.84 -48.15 73.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.307 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.405 ' O ' HD11 ' A' ' 179' ' ' ILE . 86.1 m -56.06 -43.44 77.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.959 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.446 ' HB3' ' CD ' ' A' ' 138' ' ' GLU . 63.3 mttp -53.37 -46.89 69.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.052 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.505 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 1.8 mp -58.16 -41.74 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.691 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . 0.418 ' HA ' ' HD2' ' A' ' 181' ' ' ARG . 1.2 m-20 -55.76 -44.37 77.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.194 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.46 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 1.7 mp -59.36 -46.34 92.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.163 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.871 HG21 HD12 ' A' ' 184' ' ' LEU . 44.6 mt -57.81 -41.11 79.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.728 0.299 . . . . 0.0 110.889 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 98.4 mtt180 -55.04 -50.32 69.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.225 0.536 . . . . 0.0 110.82 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.47 ' HE1' ' HB2' ' A' ' 182' ' ' MET . 25.1 ttm -67.49 -42.99 82.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.093 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 3.3 mm100 -62.16 -47.8 82.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.82 0.343 . . . . 0.0 111.474 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.871 HD12 HG21 ' A' ' 180' ' ' ILE . 6.5 mp -61.69 -47.86 83.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.51 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 44.8 mmm-85 -60.25 -46.4 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.72 0.295 . . . . 0.0 110.963 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.01 -39.83 91.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.038 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.075 -179.776 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.766 0.317 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.49 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 57.3 t -61.84 -44.4 98.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.82 89.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.521 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.24 -43.13 98.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.518 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 184' ' ' LEU . 92.3 mt -67.52 -40.27 85.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.723 0.297 . . . . 0.0 111.196 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -64.44 -49.14 72.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.586 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.575 ' HB2' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -58.11 -41.38 83.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.876 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.748 ' HB3' HD12 ' A' ' 180' ' ' ILE . 12.9 mm100 -61.03 -42.12 97.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.88 0.372 . . . . 0.0 110.76 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 67.0 tp -59.64 -45.51 91.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.102 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.68 -40.88 98.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.55 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.493 ' HA ' ' NZ ' ' A' ' 140' ' ' LYS . 81.8 mt -61.33 -50.14 81.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.876 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.432 ' OE1' HD13 ' A' ' 177' ' ' ILE . 24.8 pt-20 -65.86 -39.97 91.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.278 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.8 mt -58.87 -44.91 91.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 112.046 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.493 ' NZ ' ' HA ' ' A' ' 137' ' ' ILE . 23.5 pttm -65.68 -42.95 90.65 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.868 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.5 t -64.07 -43.51 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.967 0.413 . . . . 0.0 110.627 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.548 ' HG3' HD13 ' A' ' 170' ' ' LEU . 62.7 tttm -63.08 -43.27 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.626 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.65 -43.02 98.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.834 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.32 -38.95 96.54 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.698 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.455 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -69.01 -42.18 76.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.011 0.434 . . . . 0.0 110.95 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 55.5 mt-10 -61.72 -44.72 96.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.071 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -60.25 -44.18 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.086 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.8 mmm -64.06 -48.78 74.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.348 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.6 mt -59.69 -46.46 93.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.422 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -65.67 -41.14 92.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.443 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.6 m -58.31 -45.66 87.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.859 0.361 . . . . 0.0 110.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.718 179.662 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.705 0.288 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.78 -32.42 72.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.951 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 45.5 tp -54.86 -50.6 68.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.843 0.354 . . . . 0.0 110.236 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 168' ' ' GLN . 81.3 mt -64.35 -37.98 89.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.874 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 96.9 m -56.58 -48.43 77.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.106 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.26 88.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.874 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 25.0 mt-30 -56.79 -42.76 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.446 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 164' ' ' LEU . 27.9 mt-30 -61.34 -41.59 97.29 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.228 179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.459 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 71.0 mtp -58.63 -47.34 84.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.494 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.548 HD13 ' HG3' ' A' ' 142' ' ' LYS . 57.0 tp -58.63 -40.67 83.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.887 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -57.82 -48.0 81.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.903 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.47 -42.92 97.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.412 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 49.8 m -59.04 -45.91 89.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -54.67 -42.05 70.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.493 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.46 ' O ' HD11 ' A' ' 179' ' ' ILE . 85.0 m -58.76 -40.97 85.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.515 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.419 ' O ' HG13 ' A' ' 180' ' ' ILE . 54.5 mtpt -58.62 -46.69 86.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.221 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.53 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 2.0 mp -58.82 -42.49 85.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.311 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.4 m-20 -57.56 -54.89 41.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.737 0.303 . . . . 0.0 111.754 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.46 HD11 ' O ' ' A' ' 175' ' ' THR . 1.8 mp -62.38 -46.55 96.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.602 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.748 HD12 ' HB3' ' A' ' 134' ' ' GLN . 53.9 mt -57.65 -44.46 85.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.023 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 78.1 mtp180 -56.16 -39.35 72.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.429 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.2 mmt -59.13 -41.19 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.597 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.72 -44.68 77.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.635 HD22 HG21 ' A' ' 180' ' ' ILE . 4.4 mm? -61.21 -49.64 76.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.633 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 3.5 ptm85 -59.51 -44.42 93.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.137 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.411 HH11 ' HG3' ' A' ' 186' ' ' ARG . 21.2 mmt85 -62.83 -38.56 91.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.961 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.593 -179.701 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 79.4 ttt180 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.863 0.363 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 79.2 t -58.94 -51.29 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.59 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.77 -39.44 93.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.294 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.581 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -59.2 -44.69 96.24 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.58 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.783 HD11 HD12 ' A' ' 184' ' ' LEU . 87.6 mt -65.39 -44.33 87.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.853 0.358 . . . . 0.0 111.143 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.73 -46.39 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.734 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 24.2 pttm -58.98 -38.48 79.23 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.662 0.268 . . . . 0.0 110.778 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.3 mm100 -59.71 -46.49 88.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.787 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.511 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 62.2 tp -56.98 -44.85 83.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.568 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.86 -51.06 71.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.773 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.463 HD11 HG22 ' A' ' 137' ' ' ILE . 69.8 mt -60.97 -46.3 96.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.189 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.627 ' HB3' HG12 ' A' ' 177' ' ' ILE . 0.2 OUTLIER -57.39 -46.27 83.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.951 -179.779 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 94.2 mt -58.1 -42.66 86.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.662 0.268 . . . . 0.0 111.053 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.47 ' C ' ' HD3' ' A' ' 140' ' ' LYS . 7.4 tmtm? -62.13 -45.88 91.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.492 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.49 -44.49 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.205 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.89 -45.23 93.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.942 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -62.04 -39.54 92.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.695 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.3 -40.99 96.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.51 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.15 -42.77 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.981 0.419 . . . . 0.0 110.412 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 51.0 mt-10 -61.96 -40.4 95.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.673 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.448 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 0.8 OUTLIER -58.68 -44.83 90.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.546 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.465 ' HE1' ' HB3' ' A' ' 166' ' ' ALA . 69.5 mtm -66.35 -41.09 90.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.151 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.4 mt -62.8 -49.5 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.799 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 16.2 pt20 -64.13 -40.74 96.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.663 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.2 m -65.68 -42.91 90.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.472 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.1 -179.245 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 tptm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.9 tp -67.91 -33.48 74.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 69.1 tp -56.15 -47.46 78.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.423 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.0 -42.52 94.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.568 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -59.24 -41.57 89.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.954 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . 0.465 ' HB3' ' HE1' ' A' ' 148' ' ' MET . . . -61.54 -44.17 97.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 85.6 mt-30 -58.79 -41.71 87.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.895 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.35 -40.27 90.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.036 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.8 mtp -61.82 -48.54 80.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.787 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.409 ' C ' HD11 ' A' ' 170' ' ' LEU . 3.2 tm? -57.97 -45.79 86.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.811 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 98.7 mm-40 -60.94 -41.0 95.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.164 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.56 -44.57 86.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.115 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 52.8 m -66.65 -47.2 73.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.858 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.637 ' HD3' ' N ' ' A' ' 175' ' ' THR . 0.0 OUTLIER -60.25 -35.64 75.95 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.826 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.637 ' N ' ' HD3' ' A' ' 174' ' ' LYS . 85.7 m -71.47 -45.55 62.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 173' ' ' SER . 19.3 ptpt -63.81 -38.49 91.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.803 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.627 HG12 ' HB3' ' A' ' 138' ' ' GLU . 85.3 mt -63.37 -43.99 98.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.951 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -57.15 -44.04 83.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.966 0.413 . . . . 0.0 110.212 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 175' ' ' THR . 47.6 mm -61.2 -43.79 97.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.497 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 134' ' ' GLN . 72.2 mt -58.82 -48.9 84.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -51.03 -41.65 59.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.252 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.434 ' HE1' ' HB2' ' A' ' 182' ' ' MET . 48.4 tpp -60.71 -38.76 86.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.221 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -64.02 -43.72 94.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.967 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.783 HD12 HD11 ' A' ' 131' ' ' LEU . 4.2 mm? -60.64 -54.57 43.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.497 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.08 -41.05 91.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.682 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.24 -36.28 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.214 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.389 -179.525 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 127' ' ' ARG . 46.2 ttm-85 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.77 0.319 . . . . 0.0 111.446 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.528 HG11 ' N ' ' A' ' 129' ' ' ALA . 1.4 p -60.75 -44.55 97.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.255 0.55 . . . . 0.0 110.9 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.528 ' N ' HG11 ' A' ' 128' ' ' VAL . . . -58.44 -44.21 89.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.457 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.451 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.29 -44.2 98.01 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.785 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.88 -42.42 85.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.28 . . . . 0.0 111.412 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 51.0 mt-10 -64.07 -47.92 78.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.865 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -59.07 -42.64 90.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.645 0.26 . . . . 0.0 111.154 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.619 ' HB3' HD12 ' A' ' 180' ' ' ILE . 3.6 mm100 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.92 0.391 . . . . 0.0 110.697 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.8 tm? -58.76 -40.31 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.426 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.585 ' O ' ' HG2' ' A' ' 140' ' ' LYS . . . -66.91 -43.34 83.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.385 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.8 mt -59.99 -49.66 83.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.06 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 11.0 pt-20 -58.12 -43.28 87.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.065 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 77.3 mt -60.1 -42.24 94.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.665 0.269 . . . . 0.0 111.33 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 136' ' ' ALA . 14.6 mmmm -60.11 -47.31 86.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.711 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 48.4 t -64.56 -42.14 94.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.276 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.492 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.03 -50.96 71.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.269 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -64.61 -49.18 72.1 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.246 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.459 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -55.51 -36.27 63.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.974 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.48 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.2 -40.74 94.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 110.131 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.0 mt-10 -62.07 -44.51 96.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.552 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -60.2 -40.11 88.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.742 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.3 mtp -65.3 -44.58 87.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.2 mt -61.94 -44.2 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.354 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 97.4 mm-40 -67.09 -45.48 77.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.443 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -61.92 -50.34 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.644 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.644 -179.636 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 61.2 mttp . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.797 0.332 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.96 -38.13 87.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.1 tp -56.94 -47.71 80.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.06 -41.2 99.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.407 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.0 m -60.18 -47.04 87.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.62 75.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.216 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -57.34 -37.23 72.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.984 0.421 . . . . 0.0 109.91 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -60.46 -40.91 92.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.042 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.438 ' HB2' ' HE1' ' A' ' 169' ' ' MET . 40.9 mtm -61.78 -40.68 96.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.195 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 59.8 tp -61.36 -42.17 98.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.969 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.752 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 41.2 tt0 -57.86 -49.58 76.2 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.901 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 33.3 m-20 -63.0 -40.85 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.769 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 177' ' ' ILE . 45.7 t -57.88 -44.77 86.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.752 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 53.8 mtmt -58.3 -51.62 69.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.936 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.416 HG23 HD13 ' A' ' 179' ' ' ILE . 84.8 m -55.63 -41.8 74.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 172' ' ' ASP . 75.7 mmtt -60.88 -43.65 98.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.764 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.501 HG12 ' CD ' ' A' ' 138' ' ' GLU . 49.3 mt -60.93 -44.92 98.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.698 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.93 -47.37 80.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 111.587 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.521 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 69.9 mt -64.99 -50.66 73.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.515 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.619 HD12 ' HB3' ' A' ' 134' ' ' GLN . 44.7 mt -59.28 -58.92 4.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.86 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -51.01 -39.03 54.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.051 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.8 ttm -61.15 -39.41 89.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.89 0.376 . . . . 0.0 110.162 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 11.9 mm100 -62.01 -43.37 98.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.876 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.418 HD11 ' O ' ' A' ' 180' ' ' ILE . 9.5 mp -58.87 -45.97 88.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.859 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.424 HH11 ' HG2' ' A' ' 185' ' ' ARG . 47.5 mtp85 -56.0 -44.35 78.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.416 HH11 ' HG2' ' A' ' 186' ' ' ARG . 12.1 tpt180 -60.9 -33.7 73.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.646 -179.528 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.79 0.329 . . . . 0.0 111.052 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.4 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 74.5 t -60.09 -50.67 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.602 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.9 95.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.529 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.84 -41.25 99.13 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.375 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.743 ' HB3' HD23 ' A' ' 184' ' ' LEU . 97.2 mt -67.79 -44.39 77.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.789 0.328 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 65.7 mm-40 -62.82 -47.61 82.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.713 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.65 -42.65 97.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.436 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -59.0 -52.05 67.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.674 0.273 . . . . 0.0 111.159 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 52.7 tp -52.15 -43.08 63.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.123 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.99 86.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.218 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.452 HD11 HG22 ' A' ' 137' ' ' ILE . 69.9 mt -60.05 -51.37 73.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.585 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.445 ' HG3' ' HE3' ' A' ' 176' ' ' LYS . 5.1 mp0 -60.57 -37.45 81.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.4 mt -59.67 -44.95 93.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.782 0.325 . . . . 0.0 111.06 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -67.91 -46.83 70.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.391 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.01 -46.66 95.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.481 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 64.0 tttm -62.68 -45.81 91.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.801 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.66 -45.88 92.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.64 -39.98 97.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.564 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.44 -42.2 92.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 110.308 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.5 mt-10 -63.58 -40.63 97.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.677 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.67 -45.04 81.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.232 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.93 -42.02 81.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 145' ' ' ALA . 88.8 mt -58.39 -44.28 88.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.302 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.2 mt-30 -64.36 -46.35 83.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.456 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 52.1 m -62.82 -50.66 70.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.062 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.56 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.8 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.76 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 mttp . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.738 0.304 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.56 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.7 mt -60.31 -36.84 78.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.796 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 47.9 tp -56.09 -44.81 79.37 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.93 -43.65 98.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.454 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 91.0 m -62.09 -41.38 98.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -59.09 -42.56 90.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.008 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -59.34 -44.93 92.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.055 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -62.08 -37.54 85.43 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.959 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.611 ' HE1' ' HA ' ' A' ' 169' ' ' MET . 0.0 OUTLIER -58.07 -44.45 87.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.83 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.478 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 51.1 tp -65.37 -40.57 93.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.158 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -59.29 -46.29 88.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.442 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -65.03 -46.05 82.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.551 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.526 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -59.79 -47.4 85.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.605 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -58.52 -42.54 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.598 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.416 ' O ' HD11 ' A' ' 179' ' ' ILE . 90.2 m -58.81 -50.6 73.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.744 0.307 . . . . 0.0 111.293 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.445 ' HE3' ' HG3' ' A' ' 138' ' ' GLU . 52.5 mtmt -57.7 -40.84 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.028 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 173' ' ' SER . 73.1 mt -61.58 -38.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.321 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.65 -50.55 72.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.389 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.416 HD11 ' O ' ' A' ' 175' ' ' THR . 2.0 mp -64.87 -50.14 76.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.332 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.46 ' O ' HD21 ' A' ' 184' ' ' LEU . 66.1 mt -59.14 -43.22 88.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.868 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.1 tpt180 -54.83 -43.11 72.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.596 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.0 -44.95 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.606 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -61.97 -36.18 80.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.94 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.743 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.6 mm? -69.25 -41.98 76.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.425 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 79.3 mtp180 -58.09 -51.8 68.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -63.35 -36.31 83.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.159 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.872 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.515 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 21.3 tpp180 . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.687 0.28 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.59 -49.45 84.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.586 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.45 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.409 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.487 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.66 -42.33 99.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.394 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.753 ' HB3' HD23 ' A' ' 184' ' ' LEU . 83.2 mt -66.5 -44.19 83.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 0.0 110.954 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -64.26 -47.1 80.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.967 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.621 ' HB2' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -57.53 -42.12 82.24 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.596 0.236 . . . . 0.0 110.944 -179.482 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 3.4 mm100 -59.15 -43.68 92.08 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.798 0.332 . . . . 0.0 110.518 179.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.768 HD22 HG23 ' A' ' 180' ' ' ILE . 89.9 mt -60.04 -40.93 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.005 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.54 -47.37 86.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.164 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -58.78 -38.93 75.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.811 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.73 ' HB3' HD12 ' A' ' 177' ' ' ILE . 4.9 mm-40 -59.44 -46.58 88.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.235 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.4 mt -59.76 -39.81 86.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.274 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -61.46 -47.77 84.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.138 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.4 -47.1 68.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.503 ' HE3' ' HD3' ' A' ' 174' ' ' LYS . 87.2 tttt -58.45 -49.51 77.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.191 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -59.71 -43.68 94.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.562 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.676 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -58.09 -41.38 94.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.367 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.464 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.36 -40.97 94.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.056 0.455 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 56.6 mt-10 -62.75 -40.02 95.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.469 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.676 HD21 ' HA3' ' A' ' 144' ' ' GLY . 80.2 m-20 -58.03 -45.44 86.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.756 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.436 ' HB2' ' HE1' ' A' ' 148' ' ' MET . 44.3 mtm -64.78 -47.23 78.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.938 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.5 mt -55.21 -45.58 77.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.03 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.4 mt-30 -64.54 -40.8 96.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.781 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.1 m -60.33 -45.57 92.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.242 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.485 ' HH ' HD21 ' A' ' 162' ' ' LEU . 2.0 m-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.936 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . 0.471 ' HD2' ' N ' ' A' ' 161' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.675 0.274 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.485 HD21 ' HH ' ' A' ' 152' ' ' TYR . 10.4 mp -70.57 -31.66 68.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.589 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.59 -52.02 66.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.837 0.351 . . . . 0.0 110.417 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.73 -39.38 93.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.014 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.411 ' O ' ' HG2' ' A' ' 169' ' ' MET . 92.7 m -58.48 -39.94 81.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.669 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.59 94.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.777 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -56.89 -44.47 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.293 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.3 tp60 -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.291 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.445 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 77.9 mmm -63.03 -49.96 72.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.138 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 3.2 tm? -58.03 -46.6 85.05 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.609 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -64.94 -40.87 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.179 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.2 -47.63 85.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.31 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -60.27 -44.32 95.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.154 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.597 ' HZ3' ' HB3' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.93 -42.16 84.28 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.202 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.2 m -60.45 -47.26 86.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.143 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 180' ' ' ILE . 47.3 mmtm -62.21 -43.16 99.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.932 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.73 HD12 ' HB3' ' A' ' 138' ' ' GLU . 59.9 mt -60.83 -44.14 97.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -56.41 -43.39 79.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.912 0.387 . . . . 0.0 110.334 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.493 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 68.2 mt -61.73 -44.8 99.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.819 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.768 HG23 HD22 ' A' ' 135' ' ' LEU . 70.2 mt -61.08 -45.81 97.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.436 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -53.71 -46.98 70.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.77 0.319 . . . . 0.0 110.813 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.6 mmt -59.24 -38.94 81.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.288 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 84.7 mt-30 -64.85 -36.34 84.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.028 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.753 HD23 ' HB3' ' A' ' 131' ' ' LEU . 9.4 mt -60.19 -50.87 71.97 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.185 0.517 . . . . 0.0 110.818 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.64 -45.82 92.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.14 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -66.44 -33.85 76.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.208 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.765 -179.585 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.827 0.346 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -63.14 -40.04 87.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.974 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.39 98.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.795 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -64.34 -46.94 89.25 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.702 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 184' ' ' LEU . 79.6 mt -66.86 -41.13 87.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.997 0.427 . . . . 0.0 111.06 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -62.55 -48.35 79.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.795 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 64.5 pttt -60.62 -40.5 92.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.546 0.212 . . . . 0.0 111.118 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.4 mm-40 -58.55 -44.56 89.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.893 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.21 -42.2 94.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.909 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.09 -45.3 95.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.08 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.5 mt -62.26 -42.85 96.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.101 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.758 ' HB3' HD12 ' A' ' 177' ' ' ILE . 59.3 mm-40 -59.29 -45.96 89.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.327 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 139' ' ' LEU . 98.6 mt -58.72 -41.55 86.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.009 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -64.99 -45.74 84.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.164 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.1 t -65.2 -46.08 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.484 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -63.69 -47.15 82.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.102 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.62 HE21 HD22 ' A' ' 147' ' ' ASN . 70.7 tp60 -60.71 -45.27 94.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -65.77 -35.18 90.6 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.421 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.559 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.23 -43.64 81.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.993 0.425 . . . . 0.0 110.53 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.8 mt-10 -60.94 -41.18 95.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.784 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.62 HD22 HE21 ' A' ' 143' ' ' GLN . 3.7 m120 -59.0 -46.14 88.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.636 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.466 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 83.3 mtp -63.44 -47.07 83.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.921 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 145' ' ' ALA . 83.1 mt -53.01 -47.92 53.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.987 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.42 -35.88 80.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.121 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 98.8 m -58.18 -52.7 64.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.064 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.622 ' HB2' HD11 ' A' ' 163' ' ' LEU . 21.3 m-85 . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.706 0.288 . . . . 0.0 111.377 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.601 0.238 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.455 ' HB2' ' CE2' ' A' ' 152' ' ' TYR . 3.6 mm? -65.55 -40.0 92.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.601 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.622 HD11 ' HB2' ' A' ' 152' ' ' TYR . 56.0 tp -57.22 -44.53 83.82 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.542 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.421 ' HA ' HD21 ' A' ' 164' ' ' LEU . 92.4 mt -61.38 -41.25 96.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.248 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.1 m -59.56 -42.95 93.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.588 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.94 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.711 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.37 -45.82 90.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -38.78 88.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.454 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.479 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 73.3 mtp -59.94 -48.36 82.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.032 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 57.2 tp -58.42 -46.2 86.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.256 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.87 -43.96 94.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.259 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.69 -45.78 92.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.164 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.561 ' HA ' ' NZ ' ' A' ' 176' ' ' LYS . 80.8 p -61.04 -45.55 94.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.89 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 58.2 mtpt -59.89 -38.66 82.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.018 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.8 m -58.61 -48.05 82.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.963 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.561 ' NZ ' ' HA ' ' A' ' 173' ' ' SER . 37.3 mtmm -63.53 -40.54 97.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.876 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.758 HD12 ' HB3' ' A' ' 138' ' ' GLU . 59.2 mt -60.32 -40.16 83.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.209 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.92 -47.35 85.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 63.1 mt -62.73 -48.59 87.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.016 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.496 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 64.5 mt -60.68 -40.09 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.605 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -53.87 -45.14 70.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.352 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.52 -39.85 92.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.186 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -62.05 -43.07 99.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.145 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 131' ' ' LEU . 9.3 mt -58.75 -51.15 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.104 0.478 . . . . 0.0 110.624 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -57.2 -41.83 80.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.789 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -64.12 -37.01 85.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.414 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.492 -179.602 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.454 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 18.3 ttp-105 . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.768 0.318 . . . . 0.0 111.082 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.459 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 73.7 t -59.14 -50.51 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.418 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.07 85.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.269 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.819 ' HA3' ' HE3' ' A' ' 133' ' ' LYS . . . -61.14 -44.19 98.46 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.342 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 74.1 mt -66.83 -42.73 85.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.895 0.379 . . . . 0.0 110.882 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.5 mt-10 -62.86 -48.42 79.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.923 -179.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.819 ' HE3' ' HA3' ' A' ' 130' ' ' GLY . 22.7 pttp -59.48 -40.59 87.47 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.013 -179.359 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.543 HE21 ' NZ ' ' A' ' 133' ' ' LYS . 88.0 mm-40 -58.2 -44.71 88.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 110.797 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.6 mt -60.39 -44.66 95.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.29 95.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.319 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 133' ' ' LYS . 74.7 mt -59.79 -42.27 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.641 ' HB3' HD12 ' A' ' 177' ' ' ILE . 66.4 mm-40 -62.41 -41.73 98.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.369 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 98.3 mt -60.42 -40.21 90.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.372 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.55 -48.76 76.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.363 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 49.0 t -67.82 -47.29 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.484 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.4 tttm -59.36 -46.6 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.087 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.04 -46.28 89.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.645 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.569 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -60.6 -35.29 89.02 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.966 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.72 -40.5 92.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.872 0.367 . . . . 0.0 110.125 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 94.9 mt-10 -60.23 -42.44 95.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.546 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.569 HD21 ' HA3' ' A' ' 144' ' ' GLY . 77.2 m-20 -59.69 -45.89 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.835 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 88.5 mmm -67.72 -44.29 77.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.249 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.507 HG22 ' OE1' ' A' ' 167' ' ' GLN . 91.2 mt -61.8 -46.62 96.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.674 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -64.76 -42.91 94.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.816 0.341 . . . . 0.0 111.204 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.5 m -63.34 -48.6 77.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.494 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.511 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 2.1 m-30 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.994 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.935 0.398 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.511 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 94.1 mt -63.26 -35.5 80.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.544 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -54.49 -58.04 9.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.934 179.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.0 mt -54.73 -37.09 65.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.4 m -57.54 -50.17 73.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.21 97.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.507 ' OE1' HG22 ' A' ' 149' ' ' ILE . 14.1 mm-40 -57.12 -44.72 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.394 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -37.57 87.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 74.5 mtp -61.15 -50.77 71.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.445 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.41 HD21 ' HE2' ' A' ' 174' ' ' LYS . 3.5 tt -64.7 -46.74 81.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.682 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . 0.446 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 8.3 tt0 -56.49 -44.55 80.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 176' ' ' LYS . 34.5 t70 -62.15 -42.12 98.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 59.9 m -59.69 -48.19 82.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.374 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 55.2 mtmt -57.22 -49.27 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 111.38 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.4 m -55.59 -46.9 77.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.296 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.496 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 53.6 mtmt -59.6 -40.94 89.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.641 HD12 ' HB3' ' A' ' 138' ' ' GLU . 65.4 mt -63.9 -38.45 82.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.015 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -57.57 -48.33 79.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.353 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.56 -40.25 83.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.36 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.543 HD12 ' HB3' ' A' ' 134' ' ' GLN . 56.5 mt -57.45 -55.59 20.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.094 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -51.21 -40.04 57.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.007 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.461 ' HE1' ' HB3' ' A' ' 182' ' ' MET . 80.6 mtp -60.03 -39.42 85.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.304 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -68.03 -43.15 79.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.405 HD11 ' N ' ' A' ' 184' ' ' LEU . 10.0 mp -62.78 -49.58 74.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.365 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.696 ' HD3' ' N ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -60.73 -36.45 78.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.724 0.297 . . . . 0.0 110.451 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.696 ' N ' ' HD3' ' A' ' 185' ' ' ARG . 22.4 tpp180 -65.28 -42.37 93.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.153 179.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.787 179.656 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.817 0.341 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.448 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 50.8 t -59.68 -44.02 92.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.11 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -62.55 -41.18 98.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.099 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.49 -39.77 97.78 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.821 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.656 ' O ' ' HG2' ' A' ' 134' ' ' GLN . 84.8 mt -70.71 -38.74 73.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.722 0.296 . . . . 0.0 111.192 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 49.6 mt-10 -67.28 -48.31 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.486 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -63.45 -41.71 98.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.187 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.656 ' HG2' ' O ' ' A' ' 131' ' ' LEU . 1.5 pt20 -60.41 -43.11 97.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.897 0.38 . . . . 0.0 110.206 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.438 ' O ' HD12 ' A' ' 135' ' ' LEU . 3.0 tm? -54.25 -42.16 69.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -64.76 -37.04 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.765 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.551 ' CD1' ' HA ' ' A' ' 134' ' ' GLN . 69.0 mt -53.37 -49.46 53.31 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.72 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.562 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -61.69 -45.96 91.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.535 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.47 -38.21 71.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.379 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 98.3 mttt -63.45 -51.37 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.254 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.9 t -64.92 -44.18 96.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.246 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.437 ' HZ2' ' HZ1' ' A' ' 174' ' ' LYS . 62.7 tttp -59.23 -46.14 89.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -61.72 -42.3 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.869 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.58 -41.13 97.14 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.586 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.63 -44.59 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 110.293 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 50.3 mt-10 -60.19 -40.27 89.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -57.93 -47.95 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.439 ' HE1' ' HB1' ' A' ' 166' ' ' ALA . 60.3 mtm -67.94 -42.32 81.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.262 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 145' ' ' ALA . 96.2 mt -53.93 -46.88 64.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 95.4 mm-40 -65.2 -39.77 93.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.184 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.6 m -64.68 -46.25 83.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.902 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.708 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.985 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . 0.466 ' C ' ' HD3' ' A' ' 161' ' ' LYS . 7.3 tmtm? . . . . . 0 C--O 1.235 0.297 0 CA-C-O 121.015 0.436 . . . . 0.0 109.964 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.708 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 92.9 mt -64.27 -32.68 74.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.216 179.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.558 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 47.8 tp -56.33 -51.9 66.55 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.31 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.58 -42.85 79.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.4 m -56.55 -41.79 77.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.202 0.525 . . . . 0.0 109.661 178.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . 0.439 ' HB1' ' HE1' ' A' ' 148' ' ' MET . . . -69.74 -37.51 76.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.507 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.558 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 14.2 mm100 -56.45 -44.35 80.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.138 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.0 tp60 -65.69 -40.19 92.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.124 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.421 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.8 mtp -56.73 -47.58 79.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.989 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 54.5 tp -60.32 -45.49 93.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.323 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.68 -47.05 87.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.037 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.19 -40.8 97.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.812 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 177' ' ' ILE . 48.8 m -59.97 -45.87 91.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.909 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.5 mtpp -58.84 -41.25 86.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.977 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.6 m -58.77 -44.32 90.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.739 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -62.58 -41.53 99.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.562 HG12 ' HB3' ' A' ' 138' ' ' GLU . 62.1 mt -58.56 -42.9 85.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.2 m-20 -61.44 -41.01 96.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.33 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.86 -44.12 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.127 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.531 HG21 HD22 ' A' ' 184' ' ' LEU . 53.5 mt -58.74 -48.79 84.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.806 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.45 ' HE ' ' HA ' ' A' ' 178' ' ' ASP . 84.8 mtm180 -53.96 -40.8 67.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.563 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 25.8 mmt -60.05 -46.54 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.565 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.4 -41.98 90.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.911 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -61.05 -42.31 98.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.201 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 71.3 mtt-85 -58.01 -51.27 70.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 182' ' ' MET . 10.5 mpt_? -66.04 -36.81 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.812 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.791 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.556 ' HG2' HD13 ' A' ' 131' ' ' LEU . 39.3 ttm180 . . . . . 0 C--O 1.231 0.114 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.27 -48.28 89.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.677 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.97 95.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.569 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.577 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -65.07 -48.53 69.75 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.909 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.725 HD11 HD12 ' A' ' 184' ' ' LEU . 90.3 mt -64.94 -41.59 95.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.924 0.393 . . . . 0.0 111.31 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -61.09 -51.09 70.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.864 -179.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -59.48 -39.21 83.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.239 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.577 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.5 mm-40 -58.21 -44.44 88.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.713 0.292 . . . . 0.0 110.999 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.8 mt -58.77 -44.13 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.306 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.75 84.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.436 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.09 -42.49 86.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.354 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.7 mm-40 -60.06 -43.44 95.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.32 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 88.5 mt -58.42 -43.07 88.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.051 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -59.77 -48.45 81.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.508 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.8 t -68.61 -46.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.496 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 37.4 ttmt -59.25 -49.23 78.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.399 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -63.36 -42.34 98.88 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.809 0.338 . . . . 0.0 110.784 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.79 -39.16 94.99 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.947 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.519 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -64.63 -40.05 94.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.106 0.479 . . . . 0.0 109.92 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.606 ' OE2' HD23 ' A' ' 170' ' ' LEU . 64.8 mm-40 -59.81 -39.42 84.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.341 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.61 -44.05 96.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.231 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 80.5 mtp -67.09 -41.31 86.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.228 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.0 mt -61.14 -49.26 85.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.667 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -68.98 -44.14 73.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.6 m -64.66 -47.09 79.75 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.752 0.311 . . . . 0.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.461 ' N ' ' HD1' ' A' ' 152' ' ' TYR . 1.4 m-30 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.578 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 87.9 tttt . . . . . 0 C--O 1.233 0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.482 HD11 ' HA ' ' A' ' 162' ' ' LEU . 3.7 mm? -67.24 -33.85 76.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.001 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.449 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -56.57 -44.62 81.15 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.418 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.98 -44.82 91.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.606 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 88.1 m -58.98 -43.12 91.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.916 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -60.47 -41.23 93.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -59.14 -42.76 91.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.164 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -59.22 -41.22 88.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.436 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.465 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 71.6 mmm -56.42 -45.98 80.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.624 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.606 HD23 ' OE2' ' A' ' 146' ' ' GLU . 56.9 tp -58.28 -44.64 88.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.047 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -58.45 -43.75 88.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.382 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.48 -47.2 87.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.255 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 80.5 p -64.48 -45.41 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.541 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 29.4 mtpp -57.17 -44.16 83.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.48 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' THR . . . . . 0.44 ' O ' HD11 ' A' ' 179' ' ' ILE . 85.9 m -59.16 -50.16 75.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 111.047 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -59.21 -42.25 90.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.869 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 173' ' ' SER . 59.3 mt -62.07 -34.6 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.028 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -61.2 -50.75 71.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.662 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . 0.44 HD11 ' O ' ' A' ' 175' ' ' THR . 1.8 mp -62.79 -47.23 93.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.507 HG21 HD22 ' A' ' 184' ' ' LEU . 70.4 mt -58.51 -44.15 88.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.763 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.416 ' HG3' HH11 ' A' ' 181' ' ' ARG . 29.9 tpt85 -53.81 -42.81 68.78 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.345 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.78 -38.9 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.5 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -64.15 -45.22 89.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.042 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.725 HD12 HD11 ' A' ' 131' ' ' LEU . 4.4 mm? -61.67 -53.17 59.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.623 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.69 -39.55 77.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -63.28 -39.94 96.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.703 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.218 -179.886 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.452 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 47.6 ttm-85 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.76 0.314 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.63 -52.05 55.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.894 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.19 -39.27 75.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.374 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.57 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.84 -44.6 97.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.481 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.696 ' HB3' HD12 ' A' ' 184' ' ' LEU . 87.9 mt -66.51 -47.59 72.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.015 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -57.31 -49.15 77.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.676 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.584 ' HB2' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -59.96 -36.03 76.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.608 0.242 . . . . 0.0 110.833 -179.731 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.57 ' HB3' HD12 ' A' ' 180' ' ' ILE . 90.5 mm-40 -57.57 -49.29 76.86 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.677 0.275 . . . . 0.0 110.862 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.487 HD21 ' O ' ' A' ' 131' ' ' LEU . 4.3 mm? -58.98 -38.44 79.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.981 0.419 . . . . 0.0 110.968 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.44 83.97 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.743 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.5 mt -65.3 -50.7 71.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.759 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.509 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -55.0 -46.53 75.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.808 -179.441 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.8 mt -62.3 -41.07 98.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.721 0.296 . . . . 0.0 110.866 179.889 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -62.21 -44.62 96.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.692 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -64.91 -43.69 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.974 179.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.545 ' HG3' HD23 ' A' ' 170' ' ' LEU . 87.3 tttt -60.62 -45.68 93.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.624 179.804 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -62.69 -45.9 90.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.464 179.616 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.617 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -60.3 -37.7 93.46 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.124 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.38 93.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.077 0.465 . . . . 0.0 110.014 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -62.84 -46.29 88.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.283 179.324 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . 0.617 HD21 ' HA3' ' A' ' 144' ' ' GLY . 75.5 m-20 -55.89 -40.52 73.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.109 179.346 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.6 mmm -61.87 -47.31 85.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.747 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 68.9 mt -56.31 -50.84 69.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.929 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.85 -38.72 82.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.495 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.3 m -58.25 -45.93 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.31 -179.938 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 60.8 pttt . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.749 0.309 . . . . 0.0 111.691 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 90.2 mt -59.12 -40.75 86.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.37 -179.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.434 ' HA ' HD11 ' A' ' 163' ' ' LEU . 51.7 tp -60.57 -42.78 97.33 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.408 179.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.416 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 97.3 mt -55.33 -41.26 72.19 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.022 0.439 . . . . 0.0 109.95 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.404 ' O ' ' HG2' ' A' ' 169' ' ' MET . 89.4 m -60.38 -45.02 95.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.89 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.76 -45.47 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.395 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -56.13 -44.36 79.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 98.2 mm-40 -62.37 -38.04 88.03 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.452 179.13 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.463 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.5 mmm -62.39 -46.09 90.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.132 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.545 HD23 ' HG3' ' A' ' 142' ' ' LYS . 3.2 tm? -58.97 -46.76 87.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.784 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.54 -43.13 85.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.172 -179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -60.98 -45.07 96.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.082 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.524 ' O ' HG13 ' A' ' 177' ' ' ILE . 85.1 p -58.46 -45.31 88.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.871 -179.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -57.17 -42.67 81.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.754 179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 79.7 m -59.57 -44.36 93.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.585 179.623 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.458 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.2 mtpp -61.08 -41.92 97.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.48 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 173' ' ' SER . 64.4 mt -58.53 -41.02 80.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.836 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.41 -46.09 91.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.369 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.11 -46.16 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.437 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.57 HD12 ' HB3' ' A' ' 134' ' ' GLN . 69.8 mt -59.17 -40.61 81.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.29 179.28 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -55.24 -42.55 73.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.375 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -61.75 -40.47 95.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.459 179.408 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -64.44 -41.65 96.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.696 HD12 ' HB3' ' A' ' 131' ' ' LEU . 4.5 mm? -64.38 -50.95 65.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.595 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -57.86 -44.74 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.654 0.264 . . . . 0.0 111.166 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -64.44 -41.46 96.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.343 . . . . 0.0 110.953 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.001 179.895 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 19.7 ttm105 . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.824 0.345 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.04 -49.82 73.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.978 -179.429 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.01 95.86 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 -179.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.514 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.09 -51.44 56.86 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.796 -179.619 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.639 ' HB3' HD12 ' A' ' 184' ' ' LEU . 88.7 mt -65.77 -38.2 88.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.845 0.355 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -62.06 -49.07 77.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.916 -179.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.489 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 65.9 pttt -61.72 -40.76 96.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.045 -179.377 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.5 mm100 -58.56 -44.93 89.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.747 0.308 . . . . 0.0 110.836 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 98.6 mt -62.53 -36.4 82.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.136 0.494 . . . . 0.0 111.041 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . 0.59 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -67.4 -48.57 66.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.433 -179.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.46 -47.33 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.936 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.522 ' CG ' HG12 ' A' ' 177' ' ' ILE . 12.2 pt-20 -58.28 -39.61 79.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.15 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.475 ' HG ' ' N ' ' A' ' 140' ' ' LYS . 0.2 OUTLIER -70.18 -39.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.53 -179.925 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 68.4 mttm -59.34 -48.04 83.14 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.818 0.342 . . . . 0.0 110.735 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.46 -40.89 87.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.1 tttm -59.67 -44.49 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.737 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -65.24 -42.38 93.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.56 -40.94 95.22 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.476 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.459 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.64 -40.65 92.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.307 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.27 -39.78 94.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 179.507 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.06 -44.13 91.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.492 179.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.88 -45.67 88.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.088 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 145' ' ' ALA . 68.4 mt -57.88 -47.06 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.33 -47.58 73.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.765 -179.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 92.6 m -61.26 -47.84 84.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.898 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . 0.597 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.5 m-85 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.997 -179.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 27.4 tptp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.668 0.271 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . 0.597 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 93.0 mt -64.38 -34.92 79.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.91 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 56.8 tp -55.28 -48.93 73.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.759 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.41 -42.33 98.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.397 179.681 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.8 m -59.02 -42.03 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.972 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.4 94.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.5 -44.64 85.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.273 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -61.33 -40.38 94.0 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.475 179.241 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.412 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.9 mtp -58.77 -47.66 83.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.441 179.292 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.441 ' CD2' ' HE3' ' A' ' 174' ' ' LYS . 2.0 tt -60.87 -40.69 93.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.963 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -59.49 -41.46 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 179.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -61.68 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.839 179.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 177' ' ' ILE . 94.1 p -59.1 -40.21 84.64 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.384 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.441 ' HE3' ' CD2' ' A' ' 170' ' ' LEU . 99.6 mttt -57.29 -44.19 83.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.388 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.2 m -59.82 -48.13 82.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.36 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.576 ' NZ ' ' HB3' ' A' ' 176' ' ' LYS . 3.4 mmmp? -62.28 -47.32 84.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.992 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.522 HG12 ' CG ' ' A' ' 138' ' ' GLU . 60.6 mt -57.62 -46.31 86.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.71 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -58.84 -47.3 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.663 0.268 . . . . 0.0 111.532 -179.56 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.65 -50.58 75.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.9 -179.417 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.535 HG21 HD22 ' A' ' 184' ' ' LEU . 66.0 mt -61.3 -44.41 98.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 19.4 mmt85 -56.22 -40.83 74.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.805 0.336 . . . . 0.0 110.509 179.602 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.43 ' HB2' ' HE1' ' A' ' 182' ' ' MET . 50.0 tpp -59.96 -43.4 95.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.272 179.291 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.94 -40.29 97.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.679 179.517 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.639 HD12 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -62.25 -44.24 96.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.685 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 78.0 mtp180 -57.6 -43.9 85.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.619 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.422 ' HG3' HH11 ' A' ' 186' ' ' ARG . 43.0 mmm-85 -62.33 -42.26 99.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.036 -179.997 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.4 ' HG2' HH11 ' A' ' 127' ' ' ARG . 15.2 tpp85 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.687 0.28 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.8 -41.29 75.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.772 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.24 74.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.332 179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.838 ' HA3' ' HE3' ' A' ' 133' ' ' LYS . . . -61.86 -57.79 15.88 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.132 179.652 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.748 HD22 HD13 ' A' ' 184' ' ' LEU . 6.8 mp -53.63 -46.12 70.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -58.05 -55.0 40.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.681 0.277 . . . . 0.0 111.478 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.838 ' HE3' ' HA3' ' A' ' 130' ' ' GLY . 22.3 pttp -60.79 -34.16 74.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.895 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.3 mm100 -60.64 -50.21 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.247 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 4.6 mm? -55.61 -43.5 76.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.843 0.354 . . . . 0.0 111.094 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.99 79.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 133' ' ' LYS . 68.5 mt -63.16 -42.53 96.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.581 -179.682 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.705 ' HB3' HD12 ' A' ' 177' ' ' ILE . 69.0 mm-40 -59.09 -44.88 91.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.43 -179.601 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.3 mt -60.32 -40.71 91.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.773 0.32 . . . . 0.0 111.001 -179.873 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -62.11 -50.13 73.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.493 -179.795 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.75 -49.96 64.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.993 -179.34 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.9 tttt -57.57 -44.86 85.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.338 -179.433 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.87 -51.21 70.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.493 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.39 -34.83 86.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.542 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.23 -40.95 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.983 0.42 . . . . 0.0 110.421 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -60.71 -43.72 97.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.743 179.706 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.23 -43.37 98.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.933 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 84.1 mtp -63.33 -47.26 82.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.965 179.899 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.1 mt -56.68 -47.95 81.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -65.12 -40.03 93.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.039 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.4 m -56.87 -46.03 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.627 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.341 -179.726 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 CA--C 1.528 0.134 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 77.3 mt -61.17 -45.85 92.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.226 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.33 -45.65 92.68 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.0 -0.28 . . . . 0.0 111.119 -179.672 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . 0.547 ' O ' ' HB2' ' A' ' 168' ' ' GLN . 94.8 mt -57.27 -37.26 72.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.774 0.321 . . . . 0.0 110.712 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 165' ' ' THR . . . . . 0.47 ' O ' ' HG3' ' A' ' 169' ' ' MET . 88.4 m -61.81 -47.52 84.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.163 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -68.15 -49.18 62.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -56.96 -36.4 70.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 109.989 179.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' A' ' 164' ' ' LEU . 0.5 OUTLIER -62.21 -45.91 91.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.997 179.63 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 169' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 165' ' ' THR . 58.8 mtm -60.48 -39.33 87.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.426 ' C ' HD11 ' A' ' 170' ' ' LEU . 2.9 tm? -60.77 -42.04 96.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.437 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -64.96 -47.52 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.524 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -64.08 -42.27 97.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.816 -179.356 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.531 ' O ' HG13 ' A' ' 177' ' ' ILE . 86.2 p -57.83 -47.53 82.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.33 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -60.92 -48.01 83.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.607 -179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.7 m -58.04 -48.6 79.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.707 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.476 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 54.6 mtmt -59.28 -43.64 92.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.047 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.705 HD12 ' HB3' ' A' ' 138' ' ' GLU . 72.2 mt -60.9 -35.57 65.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.183 179.919 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 182' ' ' MET . 65.2 m-20 -62.25 -49.82 74.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.686 0.279 . . . . 0.0 110.806 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 39.9 mm -62.42 -50.17 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.038 0.447 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.577 HG21 ' CD1' ' A' ' 184' ' ' LEU . 88.4 mt -55.37 -49.92 69.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.277 179.555 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.728 ' HA ' HD11 ' A' ' 184' ' ' LEU . 79.5 ttt180 -49.47 -40.27 36.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.348 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.4 mmt -57.8 -41.06 81.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.867 178.951 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -66.62 -36.91 83.73 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.057 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.748 HD13 HD22 ' A' ' 131' ' ' LEU . 6.8 mp -61.29 -56.95 14.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.728 0.299 . . . . 0.0 111.28 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.47 -43.23 97.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.747 -179.189 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -60.12 -44.97 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.803 0.335 . . . . 0.0 110.987 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.479 -179.822 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' ARG . . . . . 0.516 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 20.7 ttm105 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.726 0.298 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.459 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 60.7 t -58.55 -45.94 90.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.995 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 179.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' GLY . . . . . 0.703 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -62.09 -40.61 99.17 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.333 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . 0.531 ' HB3' HD23 ' A' ' 184' ' ' LEU . 89.0 mt -67.34 -42.75 83.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.898 0.38 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 67.7 mm-40 -63.79 -46.8 83.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.75 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.703 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 65.9 pttt -59.98 -41.19 91.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.661 0.267 . . . . 0.0 111.229 -179.316 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 134' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.0 mm-40 -59.32 -46.24 89.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 135' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 60.0 tp -61.42 -41.93 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.844 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.88 85.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.285 -179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -59.15 -42.41 86.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.708 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . 0.564 ' HB3' HD12 ' A' ' 177' ' ' ILE . 65.0 mm-40 -61.97 -40.05 94.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.129 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.6 mt -59.8 -42.4 93.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.209 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.83 -49.19 71.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.189 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.68 -46.93 93.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.166 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 142' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.8 tttm -61.88 -44.16 97.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.629 179.961 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -58.69 -44.84 90.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.06 179.675 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 144' ' ' GLY . . . . . 0.465 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -65.16 -35.08 91.27 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 145' ' ' ALA . . . . . 0.536 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.58 -41.09 89.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.542 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.0 mt-10 -61.72 -42.54 99.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.687 179.722 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -61.99 -39.44 92.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.523 179.591 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 148' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.8 mtp -67.81 -41.49 83.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.274 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 149' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 145' ' ' ALA . 73.5 mt -63.33 -47.5 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.439 -179.564 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 150' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 3.1 pt20 -68.83 -45.36 71.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.768 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -66.04 -48.35 71.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.873 -179.377 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.832 -179.518 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt . . . . . 0 N--CA 1.461 0.078 0 CA-C-O 120.67 0.272 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.75 -40.33 96.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.059 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 163' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.3 tp -57.43 -48.02 80.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.832 0.348 . . . . 0.0 110.578 179.739 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.9 -39.63 94.62 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.166 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.8 m -56.47 -44.61 80.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.658 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.44 -41.3 98.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 167' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.2 mt-30 -58.03 -42.53 85.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.153 179.61 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.36 -40.03 85.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.768 179.119 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.1 mtp -59.92 -47.31 86.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.634 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 170' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 3.1 tm? -57.4 -47.49 81.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.675 -179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -60.59 -42.04 95.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -57.46 -46.41 83.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 173' ' ' SER . . . . . 0.51 ' O ' HG13 ' A' ' 177' ' ' ILE . 51.1 m -62.09 -42.97 99.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 -179.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 174' ' ' LYS . . . . . 0.589 ' NZ ' ' HB3' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.54 -42.99 84.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.492 -179.723 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.7 m -61.37 -48.73 79.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.406 -179.634 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 176' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 180' ' ' ILE . 68.3 mttm -62.87 -46.59 87.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.196 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 177' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 138' ' ' GLU . 54.6 mt -59.99 -40.23 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.138 -179.776 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 178' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' A' ' 182' ' ' MET . 8.2 t70 -58.03 -44.67 87.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.001 0.429 . . . . 0.0 109.99 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.99 -43.05 97.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.926 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 180' ' ' ILE . . . . . 0.505 HD12 ' HB3' ' A' ' 134' ' ' GLN . 71.3 mt -59.88 -46.78 93.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.129 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 181' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 73.1 mtt-85 -55.48 -44.2 76.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 182' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 92.2 mmm -59.69 -37.5 78.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.491 179.577 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -67.34 -38.93 85.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.089 179.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 184' ' ' LEU . . . . . 0.531 HD23 ' HB3' ' A' ' 131' ' ' LEU . 9.2 mt -60.49 -53.95 51.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.179 0.514 . . . . 0.0 110.768 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.2 -43.02 96.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.179 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 186' ' ' ARG . . . . . 0.408 ' HG3' HH11 ' A' ' 186' ' ' ARG . 46.1 ttm-85 -62.3 -36.11 81.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.129 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.414 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.682 -179.59 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 112.496 -0.241 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 36.3 pt -63.91 138.38 97.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.563 0.221 . . . . 0.0 111.307 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -69.8 70.04 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.915 2.41 . . . . 0.0 112.222 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.466 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . -154.97 -134.68 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.266 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 67.1 p -58.86 -37.02 75.58 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -53.94 -55.18 29.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.66 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 96.7 mt 53.05 30.79 10.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.173 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 56.8 m -75.82 -56.42 4.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.9 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -68.96 -40.93 78.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.934 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 84.3 t -61.2 -45.7 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.58 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.98 -43.88 97.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.47 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.697 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -60.85 -50.67 65.01 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.01 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.595 ' HB3' HD23 ' A' ' 184' ' ' LEU . 93.4 mt -67.26 -40.2 86.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.82 0.343 . . . . 0.0 111.427 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -62.67 -47.15 84.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.575 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.697 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 65.8 pttt -60.85 -41.64 96.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.598 0.237 . . . . 0.0 111.116 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.7 mm-40 -57.42 -44.66 84.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.901 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.31 -41.83 97.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.403 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.46 -45.71 90.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.23 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.2 -41.32 83.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.908 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.73 ' HB3' HD12 ' A' ' 177' ' ' ILE . 62.1 mm-40 -57.95 -44.28 86.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.015 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.5 mt -61.3 -39.5 90.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.225 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -62.2 -47.84 82.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.562 HG13 ' OG ' ' A' ' 173' ' ' SER . 33.5 t -72.53 -48.31 47.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.463 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.0 tttp -60.29 -54.98 39.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.158 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -61.79 -38.8 89.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.34 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.558 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.95 -40.83 98.97 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.504 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.98 -42.11 81.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 110.568 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 49.7 mt-10 -62.5 -42.32 99.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.501 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 45.2 t30 -60.61 -40.18 90.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.776 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.558 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.3 mmm -67.93 -45.25 74.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.021 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.504 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.6 mt -57.09 -49.72 78.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.659 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.501 ' NE2' ' HA ' ' A' ' 147' ' ' ASN . 15.1 pt20 -63.59 -41.33 98.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.411 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 95.1 m -60.14 -44.5 94.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.535 ' CE2' ' HB3' ' A' ' 162' ' ' LEU . 7.3 m-30 -58.43 -42.85 88.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 59.2 m -60.85 -32.76 72.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.281 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -53.63 -59.95 3.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.596 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . 0.611 ' HA3' ' HE3' ' A' ' 158' ' ' LYS . . . 157.79 -35.07 0.54 Allowed Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.284 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.7 t -49.54 -81.3 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.419 HG23 ' H ' ' A' ' 159' ' ' ASP . 87.3 m -68.07 -67.78 0.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.833 0.349 . . . . 0.0 111.021 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.611 ' HE3' ' HA3' ' A' ' 155' ' ' GLY . 39.6 ttmt 51.72 28.99 5.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.673 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.473 ' HB2' ' HB2' ' A' ' 162' ' ' LEU . 59.3 m-20 -75.22 128.63 35.9 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.611 0.244 . . . . 0.0 110.579 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -70.63 -48.26 55.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.321 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . 0.52 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 39.4 ttpt -58.22 -46.6 85.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.976 0.417 . . . . 0.0 110.571 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.535 ' HB3' ' CE2' ' A' ' 152' ' ' TYR . 4.5 mm? -67.02 -34.82 78.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.108 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.0 tp -56.13 -54.18 48.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.381 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 161' ' ' LYS . 4.3 pp -64.29 -38.49 91.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.782 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.9 m -55.63 -46.02 77.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.961 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.61 94.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 73.7 mt-30 -56.35 -46.42 79.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.572 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -62.55 -41.15 98.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.044 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.409 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 73.5 mtp -57.44 -47.94 80.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.098 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.499 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 3.3 tm? -61.44 -44.17 97.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.624 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.895 ' HA ' ' HE3' ' A' ' 174' ' ' LYS . 85.7 mt-30 -59.07 -49.49 77.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -66.98 -41.09 87.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.784 0.326 . . . . 0.0 111.321 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.607 ' O ' HG13 ' A' ' 177' ' ' ILE . 58.2 m -62.42 -50.84 69.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.026 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.895 ' HE3' ' HA ' ' A' ' 171' ' ' GLN . 22.0 pttp -60.29 -40.09 89.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.507 ' O ' HG13 ' A' ' 179' ' ' ILE . 85.0 m -58.18 -47.55 83.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.045 0.45 . . . . 0.0 111.057 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.04 -34.9 77.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.73 HD12 ' HB3' ' A' ' 138' ' ' GLU . 21.7 mt -60.66 -49.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.713 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -59.94 -36.43 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 110.227 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.507 HG13 ' O ' ' A' ' 175' ' ' THR . 61.4 mt -61.96 -48.37 88.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 134' ' ' GLN . 68.0 mt -61.93 -41.08 89.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -55.31 -43.86 75.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.444 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.7 ttm -60.91 -41.04 95.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.185 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -59.23 -40.67 86.61 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.595 HD23 ' HB3' ' A' ' 131' ' ' LEU . 11.9 mt -58.23 -54.67 44.32 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.712 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.491 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 47.9 mtp85 -54.75 -41.98 71.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.39 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.41 HH11 ' HG2' ' A' ' 186' ' ' ARG . 53.7 ttt-85 -62.8 -34.65 77.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.712 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.74 91.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.128 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.47 -40.01 89.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.362 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.491 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.1 mt-30 -60.29 -45.71 92.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.371 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.4 -47.0 77.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.629 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.74 -44.21 96.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.424 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.481 ' O ' ' HB3' ' A' ' 193' ' ' LEU . 53.4 tt0 -60.3 -53.86 52.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.307 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . 0.481 ' HB3' ' O ' ' A' ' 192' ' ' GLN . 61.6 tp 73.33 -52.06 0.7 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.459 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 59.43 106.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.826 0.346 . . . . 0.0 111.122 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.453 ' HB3' ' H ' ' A' ' 196' ' ' GLN . 3.5 m120 50.44 -152.23 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.787 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.453 ' H ' ' HB3' ' A' ' 195' ' ' ASN . 64.2 tp60 -74.53 136.64 42.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.797 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -59.2 135.1 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -59.57 133.8 88.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.16 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo . . . . . 0 C--O 1.248 1.004 0 C-N-CA 122.529 2.153 . . . . 0.0 112.209 179.895 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.124 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 49.5 mm -62.11 129.39 92.01 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.588 0.232 . . . . 0.0 111.026 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -63.89 -46.5 8.47 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.369 2.046 . . . . 0.0 111.9 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.27 80.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.44 ' O ' ' HB2' ' A' ' 124' ' ' ASN . 14.9 m 66.82 46.36 1.69 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.926 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.493 ' O ' ' HB2' ' A' ' 125' ' ' LEU . 3.1 m120 73.06 -42.35 0.53 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.139 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' A' ' 124' ' ' ASN . 94.2 mt 74.57 -42.13 0.49 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.521 0.329 . . . . 0.0 111.514 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.1 p -65.16 -49.74 68.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.666 0.27 . . . . 0.0 111.239 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.435 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 99.8 mtt180 -62.91 -42.16 99.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.228 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.495 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.3 t -56.98 -51.87 63.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.375 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.25 -40.79 97.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.114 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.81 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -61.39 -43.97 98.65 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.522 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.762 HD11 HD12 ' A' ' 184' ' ' LEU . 93.3 mt -67.5 -41.18 84.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.779 0.323 . . . . 0.0 111.197 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.2 mm-40 -63.73 -48.58 76.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.77 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.81 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 64.9 pttt -59.53 -41.53 90.23 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.014 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.628 ' HB3' HD12 ' A' ' 180' ' ' ILE . 12.9 mm100 -61.67 -39.33 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.958 0.409 . . . . 0.0 110.686 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.564 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.6 tm? -58.95 -41.74 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.392 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.92 89.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.157 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -65.39 -48.04 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.194 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.564 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 12.2 pt-20 -59.1 -45.4 90.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.375 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.98 -39.04 90.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.626 0.251 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -60.45 -44.29 95.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.209 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -66.26 -46.97 85.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.577 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.557 ' HB2' ' HG ' ' A' ' 173' ' ' SER . 40.3 ttmt -61.63 -46.81 88.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.276 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -62.69 -48.91 77.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.641 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.507 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.55 -34.62 86.63 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.753 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.604 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.87 -44.64 76.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.873 0.368 . . . . 0.0 110.348 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.526 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 51.7 mt-10 -60.15 -41.78 93.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.87 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.405 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 20.1 t-20 -59.04 -43.77 91.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.341 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.517 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.8 mmm -67.5 -45.37 76.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.6 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.604 HG13 ' O ' ' A' ' 145' ' ' ALA . 89.6 mt -52.88 -53.77 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.407 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 147' ' ' ASN . 3.0 pt20 -58.99 -36.55 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.033 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 54.9 m -54.93 -54.96 36.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.862 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.517 ' HD1' ' O ' ' A' ' 148' ' ' MET . 37.1 m-85 -75.28 -29.06 60.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.642 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 74.3 m -54.44 -40.71 68.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.979 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -136.09 -41.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -59.4 134.85 51.71 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.167 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 80.5 p -59.23 129.27 41.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.911 0.386 . . . . 0.0 111.137 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.459 ' C ' ' H ' ' A' ' 159' ' ' ASP . 98.4 m -164.42 -40.27 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.673 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 157' ' ' THR . 63.4 tttp 70.48 -24.87 0.16 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.459 ' H ' ' C ' ' A' ' 157' ' ' THR . 32.0 m-20 -72.99 60.5 0.54 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.53 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 45.7 ttt85 -54.5 -29.47 50.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.255 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -53.32 -46.77 69.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.036 0.446 . . . . 0.0 110.523 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 98.8 mt -61.02 -36.39 79.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.004 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.555 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 39.9 tp -57.37 -46.42 83.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.104 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.54 -42.75 75.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.417 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.562 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.7 m -57.19 -42.74 81.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.819 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -71.0 -35.83 72.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.297 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 13.0 mm-40 -56.92 -48.82 77.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.991 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 165' ' ' THR . 19.4 pt20 -65.45 -41.37 93.49 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.162 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.562 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.8 mtm -59.51 -38.18 80.26 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-O 120.865 0.364 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.476 ' C ' HD11 ' A' ' 170' ' ' LEU . 3.3 tm? -61.6 -45.43 94.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -59.8 -50.85 72.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.17 -39.55 93.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.557 ' HG ' ' HB2' ' A' ' 142' ' ' LYS . 43.1 t -56.86 -44.75 82.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.82 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.444 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 55.9 mtpt -61.06 -44.54 97.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.625 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -56.03 -41.69 75.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.88 -45.52 93.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.05 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.556 HD13 ' HE3' ' A' ' 142' ' ' LYS . 28.5 mt -57.85 -41.78 80.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.942 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.59 -49.31 73.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.754 0.311 . . . . 0.0 111.435 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 64.6 mt -62.12 -50.29 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.32 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.628 HD12 ' HB3' ' A' ' 134' ' ' GLN . 70.5 mt -59.13 -43.97 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -53.55 -41.09 66.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.273 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.426 ' SD ' ' HD3' ' A' ' 185' ' ' ARG . 48.0 tpp -62.62 -38.24 89.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.306 179.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.69 -44.09 94.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.259 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.762 HD12 HD11 ' A' ' 131' ' ' LEU . 4.3 mm? -58.36 -55.27 37.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.498 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 16.0 ptm180 -58.85 -38.63 79.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.727 0.299 . . . . 0.0 110.594 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.502 ' O ' ' HD3' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -57.74 -40.45 79.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.739 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.35 -46.09 90.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.414 HD21 ' O ' ' A' ' 184' ' ' LEU . 4.1 mm? -64.28 -41.66 96.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.41 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 72.8 mt-30 -59.41 -48.03 83.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.309 . . . . 0.0 111.056 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.09 -43.14 88.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -61.06 -38.7 87.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.289 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.42 ' O ' ' HG2' ' A' ' 192' ' ' GLN . 8.1 tt0 -78.04 46.16 0.57 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.155 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -175.82 122.68 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.126 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . 0.501 ' HG3' ' H ' ' A' ' 195' ' ' ASN . 31.0 tp10 -76.49 -128.23 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.534 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.501 ' H ' ' HG3' ' A' ' 194' ' ' GLU . 45.4 t30 -177.94 -50.73 0.01 OUTLIER 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.863 0.363 . . . . 0.0 110.539 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -71.29 139.51 49.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.0 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.08 130.34 45.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -174.25 137.64 0.65 Allowed Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.979 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 C--O 1.249 1.044 0 C-N-CA 122.569 2.179 . . . . 0.0 112.236 179.839 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.404 ' O ' HG21 ' A' ' 120' ' ' ILE . 12.4 tt -174.16 132.37 0.53 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-O 120.616 0.246 . . . . 0.0 110.864 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.48 -53.76 3.68 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.512 2.141 . . . . 0.0 112.126 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -72.07 144.03 48.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 81.1 p -53.74 -50.22 66.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.381 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -178.33 140.11 0.21 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.79 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.0 mp -125.26 -33.09 2.89 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.229 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 77.9 p -47.55 -42.93 24.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.851 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.487 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 6.5 tpm_? -65.46 -47.0 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 89.6 t -63.53 -52.57 56.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.898 0.38 . . . . 0.0 111.54 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.77 85.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.505 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.41 -44.42 97.64 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.572 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.728 ' HB3' HD23 ' A' ' 184' ' ' LEU . 94.8 mt -67.88 -41.0 83.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.851 0.358 . . . . 0.0 111.074 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 95.3 mt-10 -64.18 -49.19 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.537 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.458 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -57.2 -39.48 75.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.765 0.317 . . . . 0.0 110.608 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.548 ' HB3' HD12 ' A' ' 180' ' ' ILE . 95.0 mm-40 -58.29 -46.07 86.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.562 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 95.5 mt -54.62 -44.48 73.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.03 99.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.345 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.9 mt -59.74 -48.82 86.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.317 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.416 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.0 OUTLIER -55.67 -45.38 77.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.694 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 48.0 mt -62.35 -38.51 89.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -63.01 -42.81 99.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 0.0 110.479 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.69 -46.36 82.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.208 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.711 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 38.9 ttmt -61.01 -49.47 77.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -62.34 -43.55 98.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.449 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.472 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.68 -36.26 89.03 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.883 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.527 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.17 -41.77 80.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.96 0.409 . . . . 0.0 110.568 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.483 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.4 mt-10 -60.06 -44.57 94.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.999 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.541 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 19.3 t-20 -61.8 -44.86 96.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.554 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.472 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.5 mtp -61.0 -40.76 94.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 145' ' ' ALA . 85.3 mt -61.21 -51.07 77.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 147' ' ' ASN . 4.0 pp0? -66.85 -30.47 70.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.713 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.7 m -64.59 -50.61 66.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.54 -36.7 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.86 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 47.5 t -53.58 -40.2 65.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.384 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -59.85 156.5 14.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.468 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -47.26 -45.49 21.34 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.981 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 48.2 t -70.81 122.18 19.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.574 0.226 . . . . 0.0 111.015 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 84.9 m 61.66 133.64 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.553 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.573 ' NZ ' ' HB2' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -173.54 42.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.276 179.741 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.78 130.91 47.01 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.419 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -68.2 -44.66 75.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.581 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 8.4 ptpp? -57.82 -47.82 81.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.751 0.31 . . . . 0.0 110.973 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.95 -35.92 72.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.819 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.493 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -57.03 -51.26 69.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.094 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' A' ' 161' ' ' LYS . 4.2 pp -65.03 -38.52 91.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.7 m -55.63 -45.19 77.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.46 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -63.71 -40.68 97.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.325 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.6 mt-30 -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.934 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -60.69 -41.28 94.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.96 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.411 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 71.6 mtp -59.71 -47.48 85.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.477 179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.545 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 60.7 tp -57.03 -44.47 82.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.553 ' HA ' ' NZ ' ' A' ' 174' ' ' LYS . 8.3 tt0 -61.64 -43.14 99.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.081 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.41 -43.93 96.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.417 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.493 ' O ' HG13 ' A' ' 177' ' ' ILE . 89.3 p -62.29 -45.58 92.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.435 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.711 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 10.4 mtmp? -57.66 -49.64 75.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.6 m -55.73 -43.34 76.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.282 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.93 -41.01 97.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.072 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 173' ' ' SER . 64.1 mt -58.48 -41.07 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.025 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.6 -46.15 83.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.184 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.562 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 51.0 mm -62.93 -43.87 99.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.08 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.548 HD12 ' HB3' ' A' ' 134' ' ' GLN . 72.9 mt -65.64 -40.73 88.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 110.501 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.471 ' HE ' ' NH2' ' A' ' 185' ' ' ARG . 78.4 ttt180 -52.06 -52.11 53.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.393 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.559 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 21.2 ptp -62.79 -39.77 95.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.562 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 86.4 mt-30 -55.27 -43.88 75.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.717 0.294 . . . . 0.0 110.483 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.728 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.4 mm? -61.53 -39.28 90.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.471 ' NH2' ' HE ' ' A' ' 181' ' ' ARG . 21.5 mmt85 -55.85 -58.16 9.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.417 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.428 HH11 ' HG2' ' A' ' 186' ' ' ARG . 0.6 OUTLIER -67.23 -32.78 74.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.406 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 183' ' ' GLN . . . -60.19 -43.54 95.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 111.044 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 99.1 mt -69.96 -45.34 67.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.365 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 3.2 mm100 -62.02 -46.68 88.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.652 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.97 75.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.604 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -61.66 -48.98 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.917 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -69.08 -115.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 31.5 tp 64.48 41.11 5.81 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 121.157 0.503 . . . . 0.0 110.348 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 194' ' ' GLU . 37.4 tt0 -177.84 35.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.035 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.539 HD21 ' H ' ' A' ' 196' ' ' GLN . 0.8 OUTLIER -178.05 135.28 0.16 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.486 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.539 ' H ' HD21 ' A' ' 195' ' ' ASN . 70.8 mt-30 -57.6 133.91 55.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.55 139.14 57.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.165 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . -169.54 137.13 1.48 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.044 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 37.5 Cg_exo . . . . . 0 C--O 1.249 1.075 0 C-N-CA 122.601 2.201 . . . . 0.0 112.262 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 48.7 mt 58.13 66.43 2.7 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-O 120.761 0.315 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.505 ' HB2' ' H ' ' A' ' 122' ' ' ALA . 47.7 Cg_endo -67.5 -135.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.6 2.2 . . . . 0.0 112.247 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.505 ' H ' ' HB2' ' A' ' 121' ' ' PRO . . . -57.84 -46.14 85.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.764 0.316 . . . . 0.0 111.072 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 5.9 t -63.57 126.81 28.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.051 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 44.8 t30 179.17 -41.52 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.379 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.06 -37.41 71.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.831 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.4 t -59.83 -40.67 89.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.801 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.445 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 15.5 tpp85 -66.88 -48.81 67.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.316 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.441 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.1 t -61.85 -54.85 29.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.363 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.83 -38.07 86.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.104 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.583 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.23 -45.27 96.38 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.524 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.744 ' HB3' HD23 ' A' ' 184' ' ' LEU . 93.3 mt -67.88 -43.9 78.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.709 0.29 . . . . 0.0 111.155 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 58.4 mm-40 -60.11 -48.27 82.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.672 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -60.19 -40.81 91.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.179 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.8 mm100 -56.68 -45.01 82.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.692 0.282 . . . . 0.0 110.923 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.9 tp -60.12 -42.73 95.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.893 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.74 96.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.8 mt -59.47 -42.3 87.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.689 ' HB3' HD12 ' A' ' 177' ' ' ILE . 4.8 mm-40 -58.59 -43.98 89.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.42 ' HA ' HD21 ' A' ' 139' ' ' LEU . 94.2 mt -60.11 -38.26 82.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.486 ' C ' ' HD3' ' A' ' 140' ' ' LYS . 13.0 tmtt? -63.59 -52.85 59.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.228 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.1 -45.27 87.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.748 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.431 ' HG3' HD13 ' A' ' 170' ' ' LEU . 62.8 tttm -58.05 -45.77 86.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.056 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -64.06 -47.91 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.195 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.31 -32.16 79.8 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.822 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.633 ' O ' HG12 ' A' ' 149' ' ' ILE . . . -66.17 -43.99 85.32 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.105 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.6 mt-10 -58.96 -40.83 85.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.343 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -58.5 -42.63 88.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.536 ' HE3' ' HB1' ' A' ' 166' ' ' ALA . 83.5 mtp -66.4 -45.85 78.6 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.604 179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.633 HG12 ' O ' ' A' ' 145' ' ' ALA . 43.0 mm -54.65 -42.91 63.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.688 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -41.78 65.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 67.2 m -56.71 -52.86 63.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.86 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.408 ' HA ' ' O ' ' A' ' 157' ' ' THR . 24.8 m-85 -71.78 -42.68 66.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.942 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 41.3 t -54.89 120.9 7.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 20.7 p30 46.52 -164.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.043 -179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 45.68 46.47 13.07 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.78 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.464 ' HA ' ' HE3' ' A' ' 158' ' ' LYS . 36.3 t 62.62 179.09 0.14 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.7 0.286 . . . . 0.0 110.925 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.408 ' O ' ' HA ' ' A' ' 152' ' ' TYR . 77.3 p 51.06 38.64 21.21 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.676 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.794 ' H ' ' HD2' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -88.49 45.96 1.34 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.359 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 163' ' ' LEU . 56.2 m-20 -57.8 127.13 30.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 110.508 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 20.9 mmt85 -71.08 -47.71 56.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.824 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -55.14 -50.89 68.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.234 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -70.07 -35.61 74.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.112 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.1 tp -54.66 -49.2 71.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.858 0.361 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.9 mt -67.04 -35.8 80.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.38 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.6 m -57.59 -47.85 81.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.257 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . 0.536 ' HB1' ' HE3' ' A' ' 148' ' ' MET . . . -66.56 -46.54 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.089 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 85.4 mt-30 -56.8 -36.99 70.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.154 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.2 tp60 -64.24 -44.24 92.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.821 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.416 ' HG3' ' O ' ' A' ' 165' ' ' THR . 39.1 mtm -63.2 -42.39 99.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.424 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.559 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 49.1 tp -61.22 -46.23 91.3 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -61.09 -44.5 97.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.287 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -57.74 -43.26 85.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.848 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.555 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.0 m -63.13 -43.32 98.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.061 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.559 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.4 mmmm -56.07 -51.91 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.516 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.3 m -56.41 -45.87 80.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.679 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.403 ' O ' HG13 ' A' ' 180' ' ' ILE . 34.4 mmtp -62.84 -41.81 99.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.487 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.689 HD12 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -59.99 -40.16 82.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.355 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.6 -46.06 90.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.669 ' O ' ' HG3' ' A' ' 182' ' ' MET . 67.0 mt -63.22 -44.15 99.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.928 0.394 . . . . 0.0 110.761 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.484 HG21 HD22 ' A' ' 184' ' ' LEU . 69.7 mt -63.99 -38.2 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.897 0.38 . . . . 0.0 110.369 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.427 ' HG3' HH11 ' A' ' 181' ' ' ARG . 40.3 ttt85 -54.93 -49.27 71.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.251 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.669 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 4.5 ppp? -65.54 -32.9 74.74 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.559 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 73.3 mt-30 -61.03 -47.25 87.28 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.851 0.357 . . . . 0.0 110.576 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.744 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -60.19 -43.92 95.5 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.669 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.5 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 48.3 mtp85 -54.44 -44.19 72.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.601 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -63.79 -36.21 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.917 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.41 -45.43 93.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.018 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 192' ' ' GLN . 9.6 mp -65.81 -43.31 89.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.862 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.5 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 73.3 mt-30 -55.85 -45.59 78.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.69 98.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.993 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -63.8 -38.15 90.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.979 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.531 ' HG3' ' O ' ' A' ' 188' ' ' LEU . 24.8 mt-30 -58.81 -51.61 69.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.34 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . 0.479 HD21 ' O ' ' A' ' 189' ' ' GLN . 4.0 mm? -66.46 -50.5 63.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.786 0.326 . . . . 0.0 111.126 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.98 130.44 43.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.812 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -64.62 142.09 58.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.719 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -57.1 131.58 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.671 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.09 133.51 54.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.285 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . 0.502 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -173.78 56.0 0.19 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.273 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . 0.502 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 41.9 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 122.424 2.083 . . . . 0.0 112.311 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.513 HD11 ' HD2' ' A' ' 121' ' ' PRO . 6.6 tp -60.94 120.62 55.54 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 0.0 110.999 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.513 ' HD2' HD11 ' A' ' 120' ' ' ILE . 83.0 Cg_endo -80.97 46.26 2.22 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.663 2.242 . . . . 0.0 112.874 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -170.73 31.77 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 70.0 p 55.79 149.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.268 0.556 . . . . 0.0 112.311 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.41 ' N ' HD21 ' A' ' 124' ' ' ASN . 2.6 m120 -57.01 135.4 56.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.36 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 95.3 mt -146.36 -42.05 0.2 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.141 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.0 t -56.83 -46.38 81.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.05 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.44 ' O ' HD11 ' A' ' 131' ' ' LEU . 55.1 ttp85 -63.3 -53.08 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.918 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 72.6 t -47.51 -48.71 10.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.532 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.06 -37.23 81.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.56 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -60.2 -58.18 15.34 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.538 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.488 HD22 HD21 ' A' ' 184' ' ' LEU . 7.0 mp -53.25 -43.31 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.681 0.277 . . . . 0.0 111.71 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.3 mt-10 -64.36 -50.53 67.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 23.2 pttm -59.94 -37.92 80.92 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.1 mm100 -59.22 -48.79 80.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.296 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.597 HD22 HG22 ' A' ' 180' ' ' ILE . 88.0 mt -57.64 -44.14 85.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.636 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.453 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -60.93 -49.7 76.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.056 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.83 -48.75 86.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.963 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -59.33 -45.4 91.45 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 86.7 mt -58.66 -41.47 86.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 62.1 mttp -61.81 -49.71 75.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.378 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.36 -46.67 83.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 111.382 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.8 tttt -57.25 -47.35 81.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.051 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -59.07 -42.65 90.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.04 -37.65 94.9 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.188 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.415 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.27 -41.17 90.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.1 0.476 . . . . 0.0 110.243 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -63.33 -39.35 94.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.44 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.32 -44.61 88.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.428 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 18.7 mmt -63.64 -48.33 77.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.142 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.575 HD13 HD21 ' A' ' 170' ' ' LEU . 69.6 mt -55.19 -45.43 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 0.0 111.086 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.99 -39.7 90.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.091 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 153' ' ' SER . 90.5 m -65.37 -52.32 54.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.708 -179.494 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.428 ' HD1' ' O ' ' A' ' 148' ' ' MET . 10.0 m-85 -75.61 17.61 0.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.608 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 151' ' ' THR . 48.2 t -71.78 -46.41 58.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.825 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.421 ' HA ' ' CE ' ' A' ' 158' ' ' LYS . 43.4 t30 -176.22 133.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 67.72 155.73 0.62 Allowed Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.825 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 95.1 p 54.68 74.64 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.78 0.324 . . . . 0.0 111.514 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.443 HG21 ' N ' ' A' ' 158' ' ' LYS . 88.7 m 67.79 140.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.496 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.443 ' N ' HG21 ' A' ' 157' ' ' THR . 40.3 ttmt -165.8 50.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.569 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.463 ' OD2' HD11 ' A' ' 162' ' ' LEU . 64.1 t0 -61.26 129.21 40.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.372 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -66.98 -43.71 82.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.447 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -57.57 -54.11 50.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.325 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.463 HD11 ' OD2' ' A' ' 159' ' ' ASP . 10.9 mp -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.195 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.414 ' HG ' HE21 ' A' ' 167' ' ' GLN . 63.3 tp -55.66 -52.55 63.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.886 0.374 . . . . 0.0 110.464 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.452 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 87.3 mt -69.56 -37.14 76.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.491 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.44 ' O ' ' HG3' ' A' ' 169' ' ' MET . 94.6 m -55.52 -44.66 76.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.841 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . 0.403 ' HA ' ' HE1' ' A' ' 169' ' ' MET . . . -65.95 -44.49 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.564 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.414 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.3 mt-30 -58.29 -38.11 76.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.149 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 94.5 mm-40 -63.62 -42.72 98.15 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.037 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.44 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.6 mtm -64.17 -40.43 96.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.575 HD21 HD13 ' A' ' 149' ' ' ILE . 49.3 tp -62.55 -42.88 99.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.984 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -58.79 -45.39 89.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.767 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -60.61 -41.46 94.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.727 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.45 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.7 m -62.05 -42.35 99.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.945 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.7 mtpp -57.91 -44.38 86.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.004 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 92.2 m -61.0 -46.11 92.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.0 mtpp -59.89 -47.87 84.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.853 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.464 HG23 ' NH1' ' A' ' 181' ' ' ARG . 64.7 mt -60.23 -35.77 64.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.962 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . 0.569 ' HA ' ' CZ ' ' A' ' 181' ' ' ARG . 30.4 t70 -57.72 -49.41 76.63 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.404 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 42.3 mm -60.65 -39.29 81.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.4 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.597 HG22 HD22 ' A' ' 135' ' ' LEU . 66.2 mt -56.39 -53.67 37.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.569 ' CZ ' ' HA ' ' A' ' 178' ' ' ASP . 78.3 mtm-85 -52.38 -39.38 60.74 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.487 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 64.9 mtt -57.87 -40.2 79.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.434 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.4 ' C ' HD22 ' A' ' 131' ' ' LEU . 86.1 mt-30 -70.37 -41.74 72.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.222 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.508 ' O ' ' HG ' ' A' ' 188' ' ' LEU . 4.4 mm? -61.11 -51.71 67.94 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.504 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.427 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 16.9 ptm180 -59.29 -45.09 92.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.411 ' HA ' ' OE1' ' A' ' 189' ' ' GLN . 79.4 ttt180 -63.72 -35.75 81.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.098 0.475 . . . . 0.0 110.565 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . 0.429 ' HB2' ' NH1' ' A' ' 127' ' ' ARG . . . -67.39 -38.79 85.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.324 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 89.3 mt -65.79 -51.67 57.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.897 -179.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.411 ' OE1' ' HA ' ' A' ' 186' ' ' ARG . 2.7 pt20 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.894 0.378 . . . . 0.0 111.666 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.13 -40.9 82.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -60.82 -39.14 87.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.799 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.508 ' HG3' ' O ' ' A' ' 188' ' ' LEU . 26.3 mt-30 -54.84 -41.96 71.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.67 -49.77 73.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.179 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -74.02 -147.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.78 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -177.87 127.22 0.13 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.858 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -76.89 132.02 38.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.886 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -67.17 131.33 45.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.066 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 63.7 137.11 0.04 OUTLIER Pre-proline 0 CA--C 1.529 0.161 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.518 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo . . . . . 0 C--O 1.249 1.054 0 C-N-CA 122.45 2.1 . . . . 0.0 112.229 179.839 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.404 ' HA ' HD11 ' A' ' 120' ' ' ILE . 49.2 mm -61.14 125.48 83.94 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 120.506 0.193 . . . . 0.0 111.05 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.769 ' HG2' HG22 ' A' ' 123' ' ' THR . 80.2 Cg_endo -79.43 42.98 1.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.566 2.177 . . . . 0.0 112.548 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 59.38 41.81 19.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.783 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.769 HG22 ' HG2' ' A' ' 121' ' ' PRO . 53.8 p -87.49 -45.25 10.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.156 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.436 ' HA ' ' NH2' ' A' ' 127' ' ' ARG . 5.0 m120 -78.52 49.56 0.88 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.407 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 88.1 mt -93.09 -46.31 7.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.7 0.286 . . . . 0.0 111.619 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.5 m -66.77 -49.79 64.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.436 ' NH2' ' HA ' ' A' ' 124' ' ' ASN . 62.2 mtm-85 -61.14 -48.0 83.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.444 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 96.2 t -65.34 -48.82 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.294 . . . . 0.0 111.773 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.6 83.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.325 -179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.578 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.58 -46.03 95.12 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.535 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.61 -43.67 88.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.828 0.347 . . . . 0.0 111.093 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -60.64 -50.84 71.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.867 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.424 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 22.1 ptmt -57.93 -38.82 76.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.559 0.218 . . . . 0.0 110.907 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.0 mm-40 -57.92 -45.33 86.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.803 0.335 . . . . 0.0 110.66 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.503 ' HA ' ' CD ' ' A' ' 138' ' ' GLU . 60.5 tp -60.27 -38.34 83.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.271 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.6 80.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.07 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.8 mt -64.57 -49.09 82.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.664 ' OE1' HG13 ' A' ' 180' ' ' ILE . 7.6 pt-20 -57.89 -44.8 86.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.1 mt -59.89 -42.17 93.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.752 0.311 . . . . 0.0 110.943 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -59.39 -45.26 91.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.02 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.3 t -65.86 -45.94 90.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.667 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.649 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 40.2 ttmt -60.16 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.679 0.276 . . . . 0.0 111.107 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.31 -43.4 98.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.856 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.2 -37.86 94.68 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.335 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.523 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.37 -42.88 82.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 110.417 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.48 -41.22 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.736 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -58.07 -45.66 86.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.613 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 92.0 mmm -65.6 -46.04 80.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.523 HG13 ' O ' ' A' ' 145' ' ' ALA . 87.4 mt -55.79 -46.24 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.181 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 72.9 mt-30 -62.16 -41.2 98.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.0 m -64.79 -37.74 88.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.584 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -75.25 -34.39 61.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.109 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 89.2 p -60.31 -48.23 82.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -65.04 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -67.75 -55.83 13.15 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.487 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.5 t -59.43 123.63 17.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.775 0.288 . . . . 0.0 110.523 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 91.0 m 63.11 140.17 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.921 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -166.14 36.53 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 111.461 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.596 ' OD1' ' HB3' ' A' ' 162' ' ' LEU . 1.3 p30 -68.79 130.83 43.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.549 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.606 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 41.3 mmm-85 -74.52 -55.72 5.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . 0.613 ' NZ ' ' HB2' ' A' ' 161' ' ' LYS . 0.0 OUTLIER -59.74 -50.94 71.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.599 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.596 ' HB3' ' OD1' ' A' ' 159' ' ' ASP . 60.7 tp -59.8 -43.41 94.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.494 0.188 . . . . 0.0 111.104 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.425 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 61.3 tp -59.11 -40.4 85.23 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 160' ' ' ARG . 93.9 mt -54.79 -42.71 72.11 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.065 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 93.2 m -57.42 -46.02 83.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.262 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.15 94.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.797 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 96.8 mm-40 -57.27 -47.27 81.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.407 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.42 -38.33 89.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.021 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 69.0 mmm -59.92 -46.52 89.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.284 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.476 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 3.4 tm? -56.48 -46.97 80.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.539 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -62.88 -42.64 99.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.917 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 48.7 m -58.22 -43.94 87.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.113 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.649 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 7.5 mtpm? -59.2 -44.22 92.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.739 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.9 m -57.49 -43.53 84.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.57 ' NZ ' ' HB3' ' A' ' 176' ' ' LYS . 7.9 mtpm? -56.99 -49.68 75.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.722 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.53 HD13 ' NZ ' ' A' ' 142' ' ' LYS . 56.4 mt -57.9 -41.08 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.184 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.09 -45.96 89.52 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.889 0.376 . . . . 0.0 110.586 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 51.2 mm -58.53 -39.68 76.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.384 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.664 HG13 ' OE1' ' A' ' 138' ' ' GLU . 46.9 mm -60.68 -47.32 93.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.855 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.484 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.0 tpt85 -52.9 -42.13 65.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.186 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -60.93 -42.32 97.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.554 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -61.1 -46.11 91.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.614 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.445 ' N ' HD21 ' A' ' 184' ' ' LEU . 4.4 mm? -57.84 -42.27 84.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.868 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 51.2 mtp85 -59.9 -46.37 89.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.879 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.401 HH11 ' HG2' ' A' ' 186' ' ' ARG . 47.6 mtp85 -60.93 -37.76 83.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.083 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.68 -48.23 80.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.95 -43.98 97.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.2 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.422 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.7 mt-30 -62.16 -42.04 98.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.375 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.88 83.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.608 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.07 -47.15 81.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.753 0.311 . . . . 0.0 110.587 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -66.23 134.14 52.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 1.7 tt 59.55 50.19 7.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 109.823 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -70.03 -44.91 68.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.171 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -58.9 128.72 38.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.957 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -72.64 135.29 45.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.865 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.33 133.26 53.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.039 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -173.07 137.3 0.77 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 122.582 2.188 . . . . 0.0 112.269 -179.894 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.522 HG22 HG22 ' A' ' 123' ' ' THR . 12.1 tt -173.54 133.46 0.61 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.67 0.271 . . . . 0.0 110.961 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.438 ' HD2' HG13 ' A' ' 120' ' ' ILE . 21.0 Cg_endo -60.9 -34.18 91.47 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.772 2.315 . . . . 0.0 112.657 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.437 ' H ' HG12 ' A' ' 120' ' ' ILE . . . -52.58 -50.43 63.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.711 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.522 HG22 HG22 ' A' ' 120' ' ' ILE . 81.0 p -74.07 -145.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.247 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.425 ' HB3' ' O ' ' A' ' 123' ' ' THR . 50.1 t30 73.81 -44.37 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.67 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.29 -39.9 92.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 51.0 m -56.81 -43.38 80.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.906 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -65.14 -44.61 88.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.502 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 82.7 t -61.03 -57.15 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.6 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.73 90.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.562 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.828 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -61.16 -47.67 89.84 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.909 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.546 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 82.8 mt -67.51 -41.34 84.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.666 0.27 . . . . 0.0 111.535 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -61.76 -47.65 84.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.776 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.828 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 64.8 pttt -60.08 -42.35 94.43 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.81 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.7 mm-40 -61.04 -40.5 93.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.816 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 3.4 tm? -58.62 -46.42 87.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.248 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.505 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -66.79 -45.95 76.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.07 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.513 ' O ' HG22 ' A' ' 141' ' ' VAL . 71.2 mt -60.96 -48.62 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.478 ' CG ' HG12 ' A' ' 177' ' ' ILE . 24.3 pt-20 -59.78 -43.82 94.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.522 HD21 HD12 ' A' ' 177' ' ' ILE . 84.0 mt -59.29 -45.16 92.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.684 0.278 . . . . 0.0 110.984 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.632 ' HB3' ' HZ2' ' A' ' 140' ' ' LYS . 8.1 mtpm? -59.73 -42.91 94.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.933 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 137' ' ' ILE . 59.6 t -62.41 -40.55 88.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.734 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.547 ' HG3' HD13 ' A' ' 170' ' ' LEU . 86.3 tttt -61.35 -49.04 78.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.97 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -61.43 -44.39 97.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.516 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.17 -38.42 95.58 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.638 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.51 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.47 -41.51 84.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.976 0.417 . . . . 0.0 110.765 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 96.2 mt-10 -59.53 -44.14 93.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.021 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.85 -44.42 97.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.547 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.516 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 91.9 mmm -64.3 -42.7 96.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.238 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 167' ' ' GLN . 88.8 mt -62.63 -47.78 91.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 84.6 mt-30 -63.52 -44.94 92.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.182 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 94.5 m -62.5 -49.43 75.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.68 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.56 ' HA ' HG23 ' A' ' 157' ' ' THR . 2.7 m-30 -64.29 -43.86 93.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.691 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' SER . . . . . 0.52 ' HG ' HD12 ' A' ' 163' ' ' LEU . 61.0 m -78.41 48.71 0.79 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.297 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.54 ' ND2' ' H ' ' A' ' 155' ' ' GLY . 39.2 t30 -166.14 -138.59 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 121.104 -0.238 . . . . 0.0 111.137 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . 0.54 ' H ' ' ND2' ' A' ' 154' ' ' ASN . . . -89.13 160.0 29.24 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.142 -0.551 . . . . 0.0 113.719 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 37.7 t 63.85 24.99 13.92 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 122.685 0.394 . . . . 0.0 111.673 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.56 HG23 ' HA ' ' A' ' 152' ' ' TYR . 28.3 m -170.34 147.14 3.0 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.689 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -156.93 22.26 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 111.124 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -75.74 90.92 2.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.505 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.482 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 48.1 mmt-85 -65.18 -45.24 85.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.481 -179.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . 0.411 ' HZ3' ' HG ' ' A' ' 162' ' ' LEU . 22.0 pttp -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.77 0.319 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.411 ' HG ' ' HZ3' ' A' ' 161' ' ' LYS . 90.7 mt -64.53 -37.68 88.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.368 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.52 HD12 ' HG ' ' A' ' 153' ' ' SER . 62.8 tp -58.51 -42.66 88.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.43 179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 160' ' ' ARG . 85.1 mt -63.05 -38.73 92.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.402 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.442 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.0 m -65.43 -41.74 93.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.888 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.91 -48.63 70.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.597 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.526 ' HA ' HD12 ' A' ' 149' ' ' ILE . 3.2 pt20 -58.24 -38.57 77.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.077 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -63.09 -39.98 96.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.827 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.442 ' HG3' ' O ' ' A' ' 165' ' ' THR . 68.5 mtp -61.58 -46.33 90.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.813 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.547 HD13 ' HG3' ' A' ' 142' ' ' LYS . 56.2 tp -57.02 -46.1 82.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.286 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -60.87 -46.8 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.22 -42.42 98.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.539 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.6 m -62.86 -49.74 73.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.429 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.9 mtpp -57.14 -43.24 82.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.011 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.432 ' O ' HD11 ' A' ' 179' ' ' ILE . 91.1 m -59.01 -47.42 85.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.94 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.3 -40.21 81.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.539 HG13 ' O ' ' A' ' 173' ' ' SER . 53.0 mt -59.74 -39.78 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -62.47 -53.13 59.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.279 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.432 HD11 ' O ' ' A' ' 175' ' ' THR . 2.0 mp -62.48 -56.15 19.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.084 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.557 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 68.0 mt -52.7 -40.24 33.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.627 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.482 ' HA ' ' HG ' ' A' ' 184' ' ' LEU . 15.6 tpp85 -54.77 -43.95 73.23 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.984 0.421 . . . . 0.0 110.081 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.41 ' HE1' ' HB3' ' A' ' 182' ' ' MET . 91.2 mmm -57.32 -43.7 83.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.458 179.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.41 ' HB3' HD23 ' A' ' 131' ' ' LEU . 9.8 mp0 -67.32 -32.27 73.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.276 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 180' ' ' ILE . 20.7 mt -57.09 -57.13 13.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.252 0.549 . . . . 0.0 110.663 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 14.7 ptp180 -62.6 -41.57 99.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.182 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' A' ' 186' ' ' ARG . 4.7 tmm_? -59.22 -40.27 85.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -67.47 -45.87 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.565 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.501 ' HA ' ' OD2' ' A' ' 191' ' ' ASP . 79.7 mt -60.25 -48.14 83.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.972 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 15.6 pt20 -62.1 -45.06 95.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.942 0.401 . . . . 0.0 111.419 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -61.68 -52.07 65.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.193 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . 0.501 ' OD2' ' HA ' ' A' ' 188' ' ' LEU . 3.0 p30 -61.79 -27.95 69.11 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.896 0.379 . . . . 0.0 110.413 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -76.68 54.08 0.94 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.607 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -164.16 -43.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.074 -179.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 58.59 -126.63 1.44 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -155.28 -40.27 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.806 0.336 . . . . 0.0 110.537 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -57.3 136.3 56.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.859 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.14 135.05 57.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.305 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -64.04 137.57 97.15 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.191 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 C--O 1.249 1.033 0 C-N-CA 122.556 2.17 . . . . 0.0 112.207 -179.974 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.484 -0.247 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.439 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 2.6 mp -65.18 131.75 95.16 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.565 0.222 . . . . 0.0 110.74 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 22.7 Cg_exo -65.41 -148.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.684 2.256 . . . . 0.0 112.724 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.12 64.59 5.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.572 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.9 t -158.58 140.07 13.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 111.356 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.6 m120 60.76 37.91 18.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.042 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.49 -47.15 12.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 52.5 m -63.24 -33.45 75.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.338 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.554 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 5.5 tpm_? -58.35 -49.79 75.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.475 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.2 t -65.49 -51.51 62.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.51 93.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.921 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.572 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.79 -49.67 66.7 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.827 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.422 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 98.1 mt -65.74 -44.85 84.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.831 0.348 . . . . 0.0 111.083 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -56.81 -50.8 71.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.627 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 15.0 ptmm? -58.71 -36.63 74.56 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.414 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.699 ' HB3' HD12 ' A' ' 180' ' ' ILE . 3.5 mm100 -56.2 -45.22 79.9 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.509 179.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.441 HD11 ' OE2' ' A' ' 138' ' ' GLU . 4.5 mm? -58.74 -41.18 85.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.065 0.46 . . . . 0.0 110.485 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.1 89.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.935 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 69.7 mt -66.46 -49.53 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.127 -179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.639 ' OE1' HD12 ' A' ' 177' ' ' ILE . 1.4 pp20? -60.19 -43.32 96.0 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.464 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.495 ' HG ' ' OE2' ' A' ' 138' ' ' GLU . 93.1 mt -56.54 -45.31 81.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.82 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -62.39 -47.06 85.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.4 ' O ' ' HB1' ' A' ' 145' ' ' ALA . 61.5 t -64.93 -40.83 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.424 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 61.8 tttm -62.21 -50.21 72.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.173 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.01 -44.89 91.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.763 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.456 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -63.15 -34.78 90.89 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.534 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.07 -42.48 80.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.952 0.406 . . . . 0.0 110.799 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.4 mt-10 -60.7 -43.59 97.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -60.99 -41.36 96.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.456 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.2 mtp -64.66 -44.3 90.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 79.9 mt -58.64 -50.29 79.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.544 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -65.48 -39.97 92.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.502 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.8 m -57.4 -49.33 76.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.779 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.554 ' HB2' HD12 ' A' ' 163' ' ' LEU . 4.2 m-85 -72.3 -43.12 64.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.708 0.29 . . . . 0.0 111.355 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 69.9 m -54.38 139.13 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.106 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 5.3 m120 66.12 135.67 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.095 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 79.39 -35.99 2.0 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.895 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' SER . . . . . 0.598 ' HB2' HH21 ' A' ' 160' ' ' ARG . 43.7 t 61.83 49.08 4.98 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.005 0.431 . . . . 0.0 110.793 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 62.3 m -57.72 -35.12 70.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.337 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.487 ' HG3' ' N ' ' A' ' 159' ' ' ASP . 53.9 tptt -130.48 170.35 14.34 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.669 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 158' ' ' LYS . 31.2 m-20 -54.25 136.98 42.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.09 0.471 . . . . 0.0 111.537 -179.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.598 HH21 ' HB2' ' A' ' 156' ' ' SER . 21.7 mmt85 -64.61 -32.78 74.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.487 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -53.06 -45.25 68.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.037 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.441 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 98.2 mt -62.91 -38.3 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.255 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' ' 152' ' ' TYR . 54.5 tp -58.12 -43.4 87.18 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.51 -42.49 92.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.529 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.7 m -59.06 -43.04 91.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.944 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.01 -44.16 97.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.441 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -57.74 -43.23 85.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.398 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -60.51 -38.02 83.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.048 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.446 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 70.6 mtp -62.11 -47.22 85.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.848 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.455 ' HB2' ' HB2' ' A' ' 145' ' ' ALA . 3.4 tm? -57.8 -48.55 79.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.006 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.423 HE21 ' HB3' ' A' ' 171' ' ' GLN . 0.0 OUTLIER -62.43 -43.53 98.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.013 -179.629 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.549 ' OD1' ' HE2' ' A' ' 176' ' ' LYS . 8.7 t70 -61.29 -43.58 98.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.092 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.54 ' O ' HG13 ' A' ' 177' ' ' ILE . 38.8 t -59.72 -46.17 89.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -57.93 -40.31 80.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.901 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 88.7 m -58.62 -45.93 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.549 ' HE2' ' OD1' ' A' ' 172' ' ' ASP . 68.0 mttm -61.07 -43.81 98.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.639 HD12 ' OE1' ' A' ' 138' ' ' GLU . 63.0 mt -55.61 -40.87 61.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.355 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -64.97 -48.62 73.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.073 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 43.4 mm -61.73 -47.19 94.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.699 HD12 ' HB3' ' A' ' 134' ' ' GLN . 74.8 mt -61.82 -40.58 87.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.001 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 181' ' ' ARG . 41.5 ttt85 -55.18 -44.75 75.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 43.9 tpp -61.23 -39.98 92.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.154 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -59.66 -41.01 89.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.709 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.422 ' CD2' ' HB3' ' A' ' 131' ' ' LEU . 8.2 mt -59.31 -43.99 92.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.226 0.536 . . . . 0.0 109.954 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.587 ' HA ' HH11 ' A' ' 185' ' ' ARG . 3.3 mmm180 -56.6 -41.87 77.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.218 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.95 -39.39 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.716 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.65 -44.96 95.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.018 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.02 -41.72 99.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.731 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.43 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.0 mt-30 -64.51 -36.19 83.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.82 59.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.554 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -72.25 -60.04 2.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.011 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -74.44 134.15 42.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.964 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 62.8 tp -172.48 128.28 0.54 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.918 0.389 . . . . 0.0 111.042 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -72.88 -134.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.858 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.537 HD21 ' H ' ' A' ' 196' ' ' GLN . 0.8 OUTLIER -171.1 135.88 1.03 Allowed 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.656 0.265 . . . . 0.0 110.416 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.537 ' H ' HD21 ' A' ' 195' ' ' ASN . 54.2 tt0 -138.76 135.16 34.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.024 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.1 138.2 58.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.24 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -59.45 140.2 88.61 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.046 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo . . . . . 0 C--O 1.248 1.014 0 C-N-CA 122.577 2.185 . . . . 0.0 112.367 -179.96 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.575 -0.21 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.49 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 7.1 tp -171.89 125.52 0.55 Allowed Pre-proline 0 CA--C 1.532 0.285 0 CA-C-O 120.564 0.221 . . . . 0.0 110.923 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 2.9 Cg_exo -76.01 49.32 2.49 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.038 2.492 . . . . 0.0 112.742 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -163.39 -151.88 0.19 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.067 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 124' ' ' ASN . 74.6 p -84.88 -65.64 0.99 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.665 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 123' ' ' THR . 17.8 t-20 178.45 46.32 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.35 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.0 pp -75.54 -26.23 57.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.393 -179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.9 m -54.8 -49.53 70.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.827 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.554 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 4.0 mmp_? -62.33 -45.47 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.707 0.289 . . . . 0.0 111.537 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.474 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 59.8 t -58.64 -46.21 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.61 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.72 92.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.702 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.724 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -65.62 -44.98 91.68 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.117 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.738 HD11 HD12 ' A' ' 184' ' ' LEU . 92.4 mt -65.61 -43.22 90.3 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.744 -0.268 . . . . 0.0 111.474 -179.378 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.8 mm-40 -64.39 -46.61 82.58 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.724 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 66.0 pttt -57.83 -41.12 81.65 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.771 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.538 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 13.2 mm100 -59.46 -43.27 93.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.692 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -60.43 -43.82 96.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.88 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.3 84.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.485 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.1 -40.93 76.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.59 ' HB3' HD12 ' A' ' 177' ' ' ILE . 63.2 mm-40 -61.67 -42.1 98.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.0 mt -59.16 -42.83 91.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.292 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.07 -47.75 83.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.732 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . 0.496 HG13 ' HG ' ' A' ' 173' ' ' SER . 38.7 t -71.28 -48.77 52.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -60.88 -52.21 66.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.5 -179.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.21 -46.44 88.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.832 0.349 . . . . 0.0 110.752 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.581 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -62.34 -34.84 90.52 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.149 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.561 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.89 -40.3 91.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.937 0.399 . . . . 0.0 110.211 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -59.84 -42.08 92.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.32 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.581 HD21 ' HA3' ' A' ' 144' ' ' GLY . 76.7 m-20 -59.99 -42.12 93.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.201 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.5 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 89.1 mmm -64.46 -42.66 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.63 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.561 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.3 mt -60.69 -50.46 80.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.472 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -66.13 -42.52 89.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.761 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.479 HG23 ' HG1' ' A' ' 157' ' ' THR . 96.2 m -60.42 -49.53 77.21 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.55 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.2 m-85 -73.54 -51.33 17.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.717 0.294 . . . . 0.0 111.706 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.5 t -64.93 134.55 54.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.981 0.419 . . . . 0.0 111.747 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.401 ' N ' HD21 ' A' ' 154' ' ' ASN . 2.9 m120 55.8 45.59 23.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.531 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 169.42 132.03 1.39 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.87 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 52.8 m -62.25 142.22 57.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.529 0.204 . . . . 0.0 110.46 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.479 ' HG1' HG23 ' A' ' 151' ' ' THR . 86.7 m -155.54 -53.51 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.391 -179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.544 ' HG2' ' H ' ' A' ' 159' ' ' ASP . 20.8 ttmm -176.01 -132.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.858 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.544 ' H ' ' HG2' ' A' ' 158' ' ' LYS . 57.8 m-20 -71.23 137.71 48.87 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 111.856 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.595 ' HE ' HD22 ' A' ' 163' ' ' LEU . 12.0 tpt180 -71.78 -37.09 70.49 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.543 179.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -53.31 -41.72 65.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.609 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.55 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 97.2 mt -58.4 -39.02 78.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.437 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.595 HD22 ' HE ' ' A' ' 160' ' ' ARG . 30.8 tp -57.78 -46.86 83.98 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.068 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.432 ' HA ' HD21 ' A' ' 164' ' ' LEU . 93.2 mt -58.77 -41.72 87.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.938 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 86.8 m -61.12 -41.32 96.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.519 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.29 80.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.445 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -60.41 -45.47 93.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.133 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -62.5 -40.78 97.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.538 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.459 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.6 mmm -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.58 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 2.9 tm? -61.48 -44.32 97.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.3 -47.17 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.288 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 63.6 t0 -66.38 -40.95 90.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.191 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.5 m -62.12 -52.41 63.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.914 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.595 ' NZ ' ' HB2' ' A' ' 174' ' ' LYS . 0.0 OUTLIER -61.83 -41.65 98.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.506 -179.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 93.4 m -57.84 -48.53 79.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.795 0.331 . . . . 0.0 111.255 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.631 ' HB3' ' HZ3' ' A' ' 176' ' ' LYS . 4.0 mmmp? -58.98 -40.25 84.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.59 HD12 ' HB3' ' A' ' 138' ' ' GLU . 40.0 mt -59.91 -38.63 77.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 58.2 m-20 -60.86 -45.04 96.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 110.009 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.472 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 56.9 mt -59.59 -49.05 85.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.361 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.593 HG23 HD22 ' A' ' 184' ' ' LEU . 70.5 mt -62.18 -36.42 74.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.606 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 185' ' ' ARG . 51.2 ttt-85 -52.39 -50.29 62.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.543 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 62.0 mtm -63.54 -38.75 92.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.871 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 24.5 mt-30 -56.72 -46.42 81.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.747 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.738 HD12 HD11 ' A' ' 131' ' ' LEU . 4.3 mm? -61.92 -42.12 98.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.002 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.562 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 3.7 mmp_? -52.42 -48.27 65.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.21 -35.32 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.459 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.11 89.06 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.789 0.328 . . . . 0.0 111.171 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.468 HD23 ' NH2' ' A' ' 185' ' ' ARG . 9.9 mp -67.58 -41.88 83.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.193 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.562 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 94.8 mm-40 -56.58 -45.54 81.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.802 0.334 . . . . 0.0 111.021 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -36.9 70.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.285 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -57.27 -49.79 74.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.669 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.541 HE21 ' HA ' ' A' ' 189' ' ' GLN . 25.8 pt20 -65.36 127.54 32.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.825 0.345 . . . . 0.0 111.047 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 41.6 tp 179.56 59.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.515 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -161.75 -37.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.404 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -53.9 -47.45 71.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.984 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -72.02 129.95 39.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.807 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -69.99 134.07 47.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.045 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . 0.562 ' N ' ' HD2' ' A' ' 199' ' ' PRO . . . -63.9 -50.44 70.18 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.633 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . 0.562 ' HD2' ' N ' ' A' ' 198' ' ' ALA . 35.8 Cg_endo . . . . . 0 C--O 1.249 1.055 0 C-N-CA 122.136 1.89 . . . . 0.0 112.333 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 112.576 -0.209 . . . . 0.0 112.576 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.584 HD13 ' HD2' ' A' ' 121' ' ' PRO . 7.8 tp -176.29 128.05 0.35 Allowed Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.551 0.215 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.584 ' HD2' HD13 ' A' ' 120' ' ' ILE . 40.7 Cg_exo -57.47 -49.24 14.18 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.391 2.061 . . . . 0.0 112.409 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.15 -95.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.293 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.9 t 42.46 48.78 4.59 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.159 0.504 . . . . 0.0 111.661 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -165.05 -37.58 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.567 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 99.2 mt -57.01 -38.69 73.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.075 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.2 t -56.0 -45.67 78.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.773 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.401 ' HG2' HH11 ' A' ' 127' ' ' ARG . 54.2 ttp85 -64.96 -42.77 94.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.759 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.25 -48.25 85.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.579 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -61.5 -45.64 93.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.701 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.572 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -57.98 -48.73 80.69 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.989 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.579 ' HB3' HD23 ' A' ' 184' ' ' LEU . 64.4 mt -68.34 -43.43 77.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.015 0.436 . . . . 0.0 111.05 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.75 -46.53 89.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 16.9 ptpt -61.71 -40.37 94.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.978 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -56.21 -45.83 79.72 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.8 0.333 . . . . 0.0 110.761 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.494 HD22 HG23 ' A' ' 180' ' ' ILE . 97.2 mt -58.91 -45.93 89.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.315 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.4 -47.76 80.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.49 HG13 ' O ' ' A' ' 133' ' ' LYS . 76.4 mt -56.56 -43.34 78.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.437 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.548 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.0 mm-40 -61.87 -41.79 98.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.158 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.2 mt -57.91 -39.95 79.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.859 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -62.69 -48.99 76.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.035 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 51.1 t -65.5 -42.49 93.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.574 ' HG3' HD23 ' A' ' 170' ' ' LEU . 61.8 tttm -59.69 -46.41 89.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.669 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -61.72 -47.23 86.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.493 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -59.97 -36.41 90.16 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.606 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.524 ' HB3' ' HB2' ' A' ' 170' ' ' LEU . . . -66.57 -41.52 88.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 110.501 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.627 ' HG2' HD22 ' A' ' 170' ' ' LEU . 58.2 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.675 179.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.493 HD21 ' HA3' ' A' ' 144' ' ' GLY . 78.7 m-20 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.654 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.479 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.0 mtp -70.57 -48.93 52.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.222 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.2 mt -53.83 -47.29 63.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.361 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -66.69 -38.17 86.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.316 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 55.6 m -61.56 -51.37 68.84 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.574 ' HB2' HD11 ' A' ' 163' ' ' LEU . 18.4 m-85 -74.82 -51.25 14.5 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' SER . . . . . 0.475 ' HB2' HD12 ' A' ' 163' ' ' LEU . 47.4 t -68.43 115.32 7.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.79 0.329 . . . . 0.0 111.622 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.413 ' HB3' ' O ' ' A' ' 153' ' ' SER . 24.1 p30 172.55 -35.22 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.516 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -167.48 -48.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.755 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 48.1 t -174.97 -50.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.76 0.28 . . . . 0.0 111.412 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 71.4 p 49.02 -145.77 0.38 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.9 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.672 ' HG3' ' H ' ' A' ' 159' ' ' ASP . 19.2 tptm -72.17 -143.25 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.672 ' H ' ' HG3' ' A' ' 158' ' ' LYS . 1.5 m-20 -72.78 127.55 32.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.508 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 34.0 ttm180 -72.17 -15.65 61.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.1 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . 0.557 ' HG2' ' HB3' ' A' ' 159' ' ' ASP . 14.6 ptmm? -53.37 -40.86 65.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.01 0.433 . . . . 0.0 110.11 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.11 -31.56 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.365 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.574 HD11 ' HB2' ' A' ' 152' ' ' TYR . 51.2 tp -57.91 -48.78 78.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.635 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.92 -44.84 91.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.821 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.1 m -60.96 -41.21 95.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.01 95.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.902 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.502 HE21 ' HG ' ' A' ' 163' ' ' LEU . 73.3 mt-30 -59.45 -40.04 85.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.101 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.596 ' HA ' HE21 ' A' ' 171' ' ' GLN . 53.3 tt0 -61.03 -39.39 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.357 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.454 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 67.2 mtp -66.16 -45.63 80.25 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.086 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.627 HD22 ' HG2' ' A' ' 146' ' ' GLU . 2.9 tm? -57.38 -52.18 66.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.256 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.596 HE21 ' HA ' ' A' ' 168' ' ' GLN . 25.6 pt20 -64.18 -40.94 97.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.375 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -61.79 -44.13 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.898 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 177' ' ' ILE . 47.6 t -59.11 -45.57 90.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.046 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.69 -41.98 87.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.907 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.0 m -56.24 -47.13 79.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.969 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.526 ' O ' HG13 ' A' ' 180' ' ' ILE . 63.7 mttp -61.43 -39.8 92.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.56 ' O ' ' HG2' ' A' ' 181' ' ' ARG . 57.7 mt -62.72 -41.58 92.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.415 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -60.57 -51.44 69.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.368 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 34.1 pt -63.07 -40.02 87.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.512 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 176' ' ' LYS . 62.4 mt -60.22 -45.34 96.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.59 0.233 . . . . 0.0 110.824 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 26.1 mmm180 -56.2 -44.13 79.17 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.324 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.744 ' HG3' HH21 ' A' ' 185' ' ' ARG . 45.8 ttm -59.36 -40.23 85.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.412 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.434 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 99.3 mm-40 -60.75 -38.28 84.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.269 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.579 HD23 ' HB3' ' A' ' 131' ' ' LEU . 8.3 mt -60.34 -43.67 96.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.227 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.744 HH21 ' HG3' ' A' ' 182' ' ' MET . 72.6 mtm180 -56.8 -46.3 81.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.176 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -65.29 -38.87 91.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.59 83.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.949 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 25.5 tp -67.76 -40.62 84.06 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.126 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.434 ' O ' ' HG ' ' A' ' 193' ' ' LEU . 98.2 mm-40 -57.77 -45.06 86.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.129 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.66 -40.67 92.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.336 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.26 -50.3 72.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.394 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -62.27 -34.39 76.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.18 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 189' ' ' GLN . 95.2 mt -76.94 46.46 0.47 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.185 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 194' ' ' GLU . 37.8 tt0 -172.65 42.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.184 0.516 . . . . 0.0 110.089 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -63.37 144.03 57.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.021 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -55.76 138.58 47.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.807 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -55.81 134.34 51.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.166 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . 0.5 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -171.03 57.27 0.26 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.092 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . 0.5 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 39.6 Cg_exo . . . . . 0 C--O 1.249 1.065 0 C-N-CA 122.479 2.119 . . . . 0.0 112.28 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.458 HD13 HG21 ' A' ' 128' ' ' VAL . 68.7 mt -60.16 131.74 89.87 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.562 0.22 . . . . 0.0 110.962 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.61 -40.95 60.71 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.595 2.197 . . . . 0.0 112.413 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.535 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -169.56 -110.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.006 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.444 ' HB ' ' O ' ' A' ' 122' ' ' ALA . 85.0 m 75.89 -40.39 0.4 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.24 0.337 . . . . 0.0 111.764 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' A' ' 125' ' ' LEU . 25.8 t-20 -169.31 -41.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 121.312 -0.155 . . . . 0.0 111.234 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.535 HD22 ' HA ' ' A' ' 122' ' ' ALA . 93.8 mt 75.11 -50.65 0.66 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.595 0.559 . . . . 0.0 111.513 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.455 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 47.3 t -60.07 -38.88 84.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.853 0.359 . . . . 0.0 110.56 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.496 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 29.7 tpt180 -60.76 -42.61 97.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.639 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.458 HG21 HD13 ' A' ' 120' ' ' ILE . 92.1 t -57.46 -53.3 45.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.347 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.83 -36.74 84.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.518 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -59.89 -43.8 97.71 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.341 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.618 ' HB3' HD13 ' A' ' 184' ' ' LEU . 77.5 mt -67.1 -41.6 86.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.89 0.376 . . . . 0.0 110.807 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -63.18 -49.63 73.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.591 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.44 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.36 -41.49 89.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.585 0.231 . . . . 0.0 110.922 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.1 mm-40 -58.61 -41.32 85.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.411 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 1.7 tm? -59.95 -43.97 94.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.641 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.84 71.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.968 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 133' ' ' LYS . 70.9 mt -58.5 -46.54 89.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.542 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.474 ' HB3' HD13 ' A' ' 177' ' ' ILE . 96.0 mt-10 -59.62 -45.32 92.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.79 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.535 ' HB3' HE21 ' A' ' 143' ' ' GLN . 70.6 mt -62.16 -33.57 74.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.341 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -58.67 -48.46 81.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.702 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.4 t -71.4 -42.21 73.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.17 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.538 ' NZ ' ' HD3' ' A' ' 174' ' ' LYS . 39.5 ttmt -58.67 -50.15 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.535 HE21 ' HB3' ' A' ' 139' ' ' LEU . 74.7 mt-30 -62.34 -42.98 99.83 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.649 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.532 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.24 -38.01 93.87 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.104 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.21 -40.94 86.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.97 0.414 . . . . 0.0 110.375 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.9 mt-10 -59.09 -44.6 91.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.268 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -39.84 91.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.798 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.0 mtp -64.57 -37.21 86.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.693 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 72.4 mt -64.62 -45.84 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.817 0.342 . . . . 0.0 111.042 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.61 -42.28 74.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.352 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.44 ' C ' ' H ' ' A' ' 153' ' ' SER . 88.8 m -68.13 -48.54 65.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.656 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.645 ' HA ' ' HB ' ' A' ' 157' ' ' THR . 1.3 m-85 -75.31 21.4 0.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.67 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' SER . . . . . 0.44 ' H ' ' C ' ' A' ' 151' ' ' THR . 65.1 m -75.95 -44.33 40.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.882 0.372 . . . . 0.0 110.715 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -172.46 -44.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -63.22 132.24 42.31 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.264 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.5 t 65.93 -74.64 0.06 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 122.407 0.283 . . . . 0.0 111.126 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.645 ' HB ' ' HA ' ' A' ' 152' ' ' TYR . 90.6 m -64.0 146.47 54.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.783 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -131.5 -37.91 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.425 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -57.77 123.78 16.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.441 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 48.3 mmt-85 -74.09 -38.36 63.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.153 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -53.21 -44.48 68.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.144 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.437 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 91.8 mt -61.35 -39.89 92.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.556 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 65.5 tp -58.66 -45.59 89.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.649 179.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.457 HD21 ' NE2' ' A' ' 167' ' ' GLN . 91.1 mt -59.45 -40.65 87.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.57 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -57.57 -42.95 84.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.753 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -60.43 -41.96 95.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.457 ' NE2' HD21 ' A' ' 164' ' ' LEU . 73.1 mt-30 -57.54 -43.06 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.319 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.755 ' HA ' HE21 ' A' ' 171' ' ' GLN . 41.1 tt0 -60.34 -40.57 91.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.126 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.766 ' HA ' ' HE1' ' A' ' 169' ' ' MET . 0.0 OUTLIER -60.74 -36.61 79.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.847 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.48 HD21 ' HA ' ' A' ' 170' ' ' LEU . 2.8 tm? -69.2 -45.81 68.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.707 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.755 HE21 ' HA ' ' A' ' 168' ' ' GLN . 24.6 pt20 -64.76 -45.96 84.15 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.513 ' OD2' ' HA ' ' A' ' 169' ' ' MET . 3.0 p30 -64.42 -37.73 88.55 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.07 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.499 ' O ' HD11 ' A' ' 177' ' ' ILE . 90.3 p -62.76 -44.04 97.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.538 ' HD3' ' NZ ' ' A' ' 142' ' ' LYS . 74.9 mmtt -54.84 -48.15 73.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.307 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.405 ' O ' HD11 ' A' ' 179' ' ' ILE . 86.1 m -56.06 -43.44 77.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.959 179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.446 ' HB3' ' CD ' ' A' ' 138' ' ' GLU . 63.3 mttp -53.37 -46.89 69.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.052 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.505 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 1.8 mp -58.16 -41.74 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.691 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . 0.418 ' HA ' ' HD2' ' A' ' 181' ' ' ARG . 1.2 m-20 -55.76 -44.37 77.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.194 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.46 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 1.7 mp -59.36 -46.34 92.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.163 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.871 HG21 HD12 ' A' ' 184' ' ' LEU . 44.6 mt -57.81 -41.11 79.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.728 0.299 . . . . 0.0 110.889 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 98.4 mtt180 -55.04 -50.32 69.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.225 0.536 . . . . 0.0 110.82 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.47 ' HE1' ' HB2' ' A' ' 182' ' ' MET . 25.1 ttm -67.49 -42.99 82.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.093 -178.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 3.3 mm100 -62.16 -47.8 82.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.82 0.343 . . . . 0.0 111.474 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.871 HD12 HG21 ' A' ' 180' ' ' ILE . 6.5 mp -61.69 -47.86 83.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.51 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.506 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 44.8 mmm-85 -60.25 -46.4 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.72 0.295 . . . . 0.0 110.963 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.01 -39.83 91.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.038 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.47 -43.99 96.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.075 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 84.5 mt -65.82 -42.73 90.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.026 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 99.3 mm-40 -61.65 -43.09 99.51 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -59.92 -45.89 91.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.108 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.24 -42.85 99.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.729 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 192' ' ' GLN . 3.1 tp-100 -79.21 45.56 0.65 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.768 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 36.7 tp -175.58 52.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.355 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -165.74 144.51 6.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.076 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -165.02 -38.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -58.47 134.5 56.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.743 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.45 133.18 55.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.281 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -174.47 133.41 0.53 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.83 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo . . . . . 0 C--O 1.249 1.052 0 C-N-CA 122.457 2.105 . . . . 0.0 112.226 179.935 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.557 ' H ' HD11 ' A' ' 120' ' ' ILE . 2.3 mp -64.18 131.1 94.9 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.575 0.226 . . . . 0.0 110.827 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -76.25 38.5 0.61 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.891 2.394 . . . . 0.0 112.497 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 55.87 50.79 13.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.787 0.327 . . . . 0.0 111.162 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 9.2 t -136.45 37.93 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.459 . . . . 0.0 111.128 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -157.78 -47.55 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.439 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.423 ' O ' HD12 ' A' ' 125' ' ' LEU . 3.1 tm? -62.14 -44.46 96.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.442 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.2 m -60.02 -44.47 94.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.056 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -60.41 -45.0 95.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.08 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.49 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 57.3 t -61.84 -44.4 98.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.82 89.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.521 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.24 -43.13 98.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.518 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.547 ' HB3' HD23 ' A' ' 184' ' ' LEU . 92.3 mt -67.52 -40.27 85.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.723 0.297 . . . . 0.0 111.196 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -64.44 -49.14 72.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.586 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.575 ' HB2' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -58.11 -41.38 83.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.876 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.748 ' HB3' HD12 ' A' ' 180' ' ' ILE . 12.9 mm100 -61.03 -42.12 97.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.88 0.372 . . . . 0.0 110.76 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.492 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 67.0 tp -59.64 -45.51 91.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.102 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.68 -40.88 98.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.55 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.493 ' HA ' ' NZ ' ' A' ' 140' ' ' LYS . 81.8 mt -61.33 -50.14 81.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.876 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.432 ' OE1' HD13 ' A' ' 177' ' ' ILE . 24.8 pt-20 -65.86 -39.97 91.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.278 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.8 mt -58.87 -44.91 91.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 112.046 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.493 ' NZ ' ' HA ' ' A' ' 137' ' ' ILE . 23.5 pttm -65.68 -42.95 90.65 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.868 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.5 t -64.07 -43.51 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.967 0.413 . . . . 0.0 110.627 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.548 ' HG3' HD13 ' A' ' 170' ' ' LEU . 62.7 tttm -63.08 -43.27 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.626 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.65 -43.02 98.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.834 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.434 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.32 -38.95 96.54 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.698 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.455 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -69.01 -42.18 76.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.011 0.434 . . . . 0.0 110.95 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 55.5 mt-10 -61.72 -44.72 96.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.071 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -60.25 -44.18 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.086 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.8 mmm -64.06 -48.78 74.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.348 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.6 mt -59.69 -46.46 93.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.422 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -65.67 -41.14 92.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.443 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.6 m -58.31 -45.66 87.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.859 0.361 . . . . 0.0 110.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.537 ' HA ' ' HB ' ' A' ' 157' ' ' THR . 2.3 m-30 -66.22 -47.78 72.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.718 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 95.5 p -71.09 128.53 36.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.333 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 2.8 m120 52.93 57.57 6.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.397 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -159.13 -143.45 3.67 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.808 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 78.8 p -110.66 49.48 0.86 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.832 0.348 . . . . 0.0 111.307 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.537 ' HB ' ' HA ' ' A' ' 152' ' ' TYR . 89.7 m -161.29 131.89 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.543 ' HD2' ' N ' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -129.27 29.6 5.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.907 -179.806 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.453 ' H ' HG21 ' A' ' 157' ' ' THR . 1.4 m-20 -73.51 93.82 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.496 179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.413 ' HG3' HH11 ' A' ' 160' ' ' ARG . 42.7 mmm-85 -65.55 -39.82 92.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.474 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -56.3 -56.63 18.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.952 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.78 -32.42 72.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.951 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 45.5 tp -54.86 -50.6 68.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.843 0.354 . . . . 0.0 110.236 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.479 ' O ' ' HG3' ' A' ' 168' ' ' GLN . 81.3 mt -64.35 -37.98 89.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.874 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 96.9 m -56.58 -48.43 77.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.106 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.26 88.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.874 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 25.0 mt-30 -56.79 -42.76 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.446 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 164' ' ' LEU . 27.9 mt-30 -61.34 -41.59 97.29 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.228 179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.459 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 71.0 mtp -58.63 -47.34 84.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.494 179.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.548 HD13 ' HG3' ' A' ' 142' ' ' LYS . 57.0 tp -58.63 -40.67 83.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.887 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -57.82 -48.0 81.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.903 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.47 -42.92 97.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.412 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 49.8 m -59.04 -45.91 89.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -54.67 -42.05 70.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.493 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.46 ' O ' HD11 ' A' ' 179' ' ' ILE . 85.0 m -58.76 -40.97 85.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.515 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.419 ' O ' HG13 ' A' ' 180' ' ' ILE . 54.5 mtpt -58.62 -46.69 86.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.221 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.53 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 2.0 mp -58.82 -42.49 85.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.311 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.4 m-20 -57.56 -54.89 41.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.737 0.303 . . . . 0.0 111.754 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.46 HD11 ' O ' ' A' ' 175' ' ' THR . 1.8 mp -62.38 -46.55 96.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.602 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.748 HD12 ' HB3' ' A' ' 134' ' ' GLN . 53.9 mt -57.65 -44.46 85.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.023 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 78.1 mtp180 -56.16 -39.35 72.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.429 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.2 mmt -59.13 -41.19 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.597 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.72 -44.68 77.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.635 HD22 HG21 ' A' ' 180' ' ' ILE . 4.4 mm? -61.21 -49.64 76.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.633 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.554 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 3.5 ptm85 -59.51 -44.42 93.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.137 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.672 ' HD3' ' NE2' ' A' ' 189' ' ' GLN . 21.2 mmt85 -62.83 -38.56 91.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.961 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.69 79.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.593 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 91.8 mt -66.03 -46.4 78.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.066 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.672 ' NE2' ' HD3' ' A' ' 186' ' ' ARG . 16.4 pt20 -62.58 -49.17 76.31 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.51 29.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -67.71 -59.77 3.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 110.979 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.429 ' HB3' ' O ' ' A' ' 188' ' ' LEU . 8.1 tt0 -84.12 133.96 34.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . 0.418 HD22 ' O ' ' A' ' 189' ' ' GLN . 36.7 mt -156.22 37.0 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.789 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 51.38 -143.22 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.07 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.471 ' OD1' ' HG3' ' A' ' 196' ' ' GLN . 20.1 p30 -174.87 -39.83 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.584 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.471 ' HG3' ' OD1' ' A' ' 195' ' ' ASN . 86.5 mt-30 -68.49 137.21 54.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.773 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.73 134.97 57.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.999 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 65.41 133.25 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.415 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--O 1.249 1.03 0 C-N-CA 122.583 2.189 . . . . 0.0 112.373 179.914 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 75.3 mt 65.05 128.2 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.821 0.343 . . . . 0.0 111.331 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.61 138.63 35.54 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.559 2.173 . . . . 0.0 112.627 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 69.91 -65.84 0.3 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.015 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.4 m -61.13 125.62 24.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.679 0.276 . . . . 0.0 110.83 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -179.12 -36.7 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.908 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 91.9 mt -54.15 -42.25 69.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.8 m -58.68 -44.99 90.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.462 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 79.4 ttt180 -64.08 -39.94 95.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.782 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 79.2 t -58.94 -51.29 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.59 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.77 -39.44 93.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.294 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.581 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -59.2 -44.69 96.24 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.58 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.783 HD11 HD12 ' A' ' 184' ' ' LEU . 87.6 mt -65.39 -44.33 87.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.853 0.358 . . . . 0.0 111.143 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.73 -46.39 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.734 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.581 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 24.2 pttm -58.98 -38.48 79.23 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.662 0.268 . . . . 0.0 110.778 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.3 mm100 -59.71 -46.49 88.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.787 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.511 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 62.2 tp -56.98 -44.85 83.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.568 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.86 -51.06 71.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.773 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.463 HD11 HG22 ' A' ' 137' ' ' ILE . 69.8 mt -60.97 -46.3 96.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.189 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.627 ' HB3' HG12 ' A' ' 177' ' ' ILE . 0.2 OUTLIER -57.39 -46.27 83.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.951 -179.779 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 94.2 mt -58.1 -42.66 86.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.662 0.268 . . . . 0.0 111.053 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.47 ' C ' ' HD3' ' A' ' 140' ' ' LYS . 7.4 tmtm? -62.13 -45.88 91.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.492 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.8 t -62.49 -44.49 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.205 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.89 -45.23 93.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.942 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -62.04 -39.54 92.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.695 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.3 -40.99 96.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.51 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.15 -42.77 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.981 0.419 . . . . 0.0 110.412 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.473 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 51.0 mt-10 -61.96 -40.4 95.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.673 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.448 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 0.8 OUTLIER -58.68 -44.83 90.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.546 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.465 ' HE1' ' HB3' ' A' ' 166' ' ' ALA . 69.5 mtm -66.35 -41.09 90.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.151 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.4 mt -62.8 -49.5 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.799 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 16.2 pt20 -64.13 -40.74 96.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.663 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.427 ' C ' ' H ' ' A' ' 153' ' ' SER . 99.2 m -65.68 -42.91 90.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.472 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.72 21.91 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.1 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' SER . . . . . 0.427 ' H ' ' C ' ' A' ' 151' ' ' THR . 73.8 m -75.67 -47.05 27.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.755 0.312 . . . . 0.0 110.584 179.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -174.13 125.92 0.35 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.878 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 152.62 -141.2 8.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.174 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 58.0 m -68.23 -51.8 41.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.146 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 75.7 p -77.86 134.84 37.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.708 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 158' ' ' LYS . 59.8 tttp -169.77 39.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.071 0.462 . . . . 0.0 111.047 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -71.56 121.29 18.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.054 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 22.3 tpp180 -72.48 -46.92 52.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -58.26 -49.74 76.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.89 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.9 tp -67.91 -33.48 74.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 69.1 tp -56.15 -47.46 78.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.423 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.0 -42.52 94.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.568 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -59.24 -41.57 89.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.954 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . 0.465 ' HB3' ' HE1' ' A' ' 148' ' ' MET . . . -61.54 -44.17 97.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 85.6 mt-30 -58.79 -41.71 87.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.895 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.35 -40.27 90.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.036 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.8 mtp -61.82 -48.54 80.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.787 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.409 ' C ' HD11 ' A' ' 170' ' ' LEU . 3.2 tm? -57.97 -45.79 86.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.811 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 98.7 mm-40 -60.94 -41.0 95.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.164 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.56 -44.57 86.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.115 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 52.8 m -66.65 -47.2 73.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.858 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.637 ' HD3' ' N ' ' A' ' 175' ' ' THR . 0.0 OUTLIER -60.25 -35.64 75.95 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.826 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.637 ' N ' ' HD3' ' A' ' 174' ' ' LYS . 85.7 m -71.47 -45.55 62.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.531 ' HG2' ' HA ' ' A' ' 173' ' ' SER . 19.3 ptpt -63.81 -38.49 91.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.803 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.627 HG12 ' HB3' ' A' ' 138' ' ' GLU . 85.3 mt -63.37 -43.99 98.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.951 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -57.15 -44.04 83.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.966 0.413 . . . . 0.0 110.212 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 175' ' ' THR . 47.6 mm -61.2 -43.79 97.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.497 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 134' ' ' GLN . 72.2 mt -58.82 -48.9 84.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -51.03 -41.65 59.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.252 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.434 ' HE1' ' HB2' ' A' ' 182' ' ' MET . 48.4 tpp -60.71 -38.76 86.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.221 179.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -64.02 -43.72 94.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.967 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.783 HD12 HD11 ' A' ' 131' ' ' LEU . 4.2 mm? -60.64 -54.57 43.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.497 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 16.3 ptm180 -60.08 -41.05 91.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.682 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.24 -36.28 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.214 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -63.43 -47.13 83.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.389 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 184' ' ' LEU . 9.8 mp -66.06 -44.09 85.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.492 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 98.9 mm-40 -62.25 -43.05 99.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.297 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.06 -51.22 68.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.732 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -64.04 -45.49 88.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.222 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -79.13 50.22 1.03 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.416 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -167.01 123.81 1.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.219 179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 55.2 mp0 -81.59 134.64 35.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.214 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -58.23 -35.24 71.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.033 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.428 ' O ' ' HD3' ' A' ' 199' ' ' PRO . 4.4 tp-100 -137.16 135.19 37.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.0 135.82 57.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.198 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 57.96 56.59 6.89 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.512 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . 0.428 ' HD3' ' O ' ' A' ' 196' ' ' GLN . 37.5 Cg_endo . . . . . 0 C--O 1.249 1.026 0 C-N-CA 122.388 2.058 . . . . 0.0 112.198 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.617 HG21 ' H ' ' A' ' 122' ' ' ALA . 69.4 mt -66.26 131.9 94.38 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.522 0.201 . . . . 0.0 111.197 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.54 -31.93 88.1 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.534 2.156 . . . . 0.0 111.963 179.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.617 ' H ' HG21 ' A' ' 120' ' ' ILE . . . 64.7 34.47 9.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.371 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 68.6 m -91.97 84.84 5.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.565 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -166.17 -36.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.091 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.419 ' O ' ' HB1' ' A' ' 129' ' ' ALA . 3.8 pp -55.82 -32.99 64.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.446 -179.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 80.3 p -68.34 -48.16 65.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.294 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 127' ' ' ARG . 46.2 ttm-85 -65.38 -45.45 84.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.528 HG11 ' N ' ' A' ' 129' ' ' ALA . 1.4 p -60.75 -44.55 97.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.255 0.55 . . . . 0.0 110.9 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.528 ' N ' HG11 ' A' ' 128' ' ' VAL . . . -58.44 -44.21 89.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.457 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.451 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.29 -44.2 98.01 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.785 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.88 -42.42 85.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.28 . . . . 0.0 111.412 -179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 51.0 mt-10 -64.07 -47.92 78.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.865 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -59.07 -42.64 90.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.645 0.26 . . . . 0.0 111.154 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.619 ' HB3' HD12 ' A' ' 180' ' ' ILE . 3.6 mm100 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.92 0.391 . . . . 0.0 110.697 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.8 tm? -58.76 -40.31 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.426 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.585 ' O ' ' HG2' ' A' ' 140' ' ' LYS . . . -66.91 -43.34 83.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.385 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 64.8 mt -59.99 -49.66 83.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.06 -179.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.536 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 11.0 pt-20 -58.12 -43.28 87.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.065 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 77.3 mt -60.1 -42.24 94.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.665 0.269 . . . . 0.0 111.33 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 136' ' ' ALA . 14.6 mmmm -60.11 -47.31 86.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.711 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 48.4 t -64.56 -42.14 94.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.276 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.492 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.03 -50.96 71.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.269 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -64.61 -49.18 72.1 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.246 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.459 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -55.51 -36.27 63.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.974 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.48 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.2 -40.74 94.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 110.131 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.0 mt-10 -62.07 -44.51 96.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.552 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -60.2 -40.11 88.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.742 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.459 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.3 mtp -65.3 -44.58 87.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.2 mt -61.94 -44.2 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.354 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 97.4 mm-40 -67.09 -45.48 77.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.443 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -61.92 -50.34 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.644 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.418 ' HA ' ' O ' ' A' ' 157' ' ' THR . 2.3 m-85 -63.47 -41.66 98.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.644 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 23.9 t -64.33 117.63 7.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.854 0.359 . . . . 0.0 111.113 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 2.9 m120 59.66 113.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.182 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 59.74 156.67 0.03 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.835 178.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 58.5 m 59.62 63.91 1.42 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.582 0.23 . . . . 0.0 111.419 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.418 ' O ' ' HA ' ' A' ' 152' ' ' TYR . 85.6 m 66.22 143.33 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.98 44.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.875 0.369 . . . . 0.0 111.478 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.64 129.1 38.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.349 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -67.05 -44.14 80.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.364 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -58.4 -48.93 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.764 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.96 -38.13 87.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.1 tp -56.94 -47.71 80.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.06 -41.2 99.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.407 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.0 m -60.18 -47.04 87.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.62 75.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.216 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -57.34 -37.23 72.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.984 0.421 . . . . 0.0 109.91 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -60.46 -40.91 92.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.042 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.438 ' HB2' ' HE1' ' A' ' 169' ' ' MET . 40.9 mtm -61.78 -40.68 96.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.195 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 59.8 tp -61.36 -42.17 98.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.969 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.752 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 41.2 tt0 -57.86 -49.58 76.2 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.901 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 33.3 m-20 -63.0 -40.85 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.769 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 177' ' ' ILE . 45.7 t -57.88 -44.77 86.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.752 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 53.8 mtmt -58.3 -51.62 69.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.936 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.416 HG23 HD13 ' A' ' 179' ' ' ILE . 84.8 m -55.63 -41.8 74.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.955 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 172' ' ' ASP . 75.7 mmtt -60.88 -43.65 98.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.764 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.501 HG12 ' CD ' ' A' ' 138' ' ' GLU . 49.3 mt -60.93 -44.92 98.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.698 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.93 -47.37 80.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 111.587 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.521 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 69.9 mt -64.99 -50.66 73.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.515 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.619 HD12 ' HB3' ' A' ' 134' ' ' GLN . 44.7 mt -59.28 -58.92 4.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.86 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -51.01 -39.03 54.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.051 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.8 ttm -61.15 -39.41 89.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.89 0.376 . . . . 0.0 110.162 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 11.9 mm100 -62.01 -43.37 98.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.876 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.418 HD11 ' O ' ' A' ' 180' ' ' ILE . 9.5 mp -58.87 -45.97 88.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.859 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.424 HH11 ' HG2' ' A' ' 185' ' ' ARG . 47.5 mtp85 -56.0 -44.35 78.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.416 HH11 ' HG2' ' A' ' 186' ' ' ARG . 12.1 tpt180 -60.9 -33.7 73.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.76 -48.77 73.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.646 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.417 HD21 ' O ' ' A' ' 184' ' ' LEU . 3.8 mm? -69.3 -44.4 71.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.581 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.2 mt-30 -62.11 -45.58 92.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.493 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.66 -45.39 90.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.444 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.44 -50.68 72.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.052 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -69.61 138.14 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.836 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . 0.47 ' O ' HD12 ' A' ' 193' ' ' LEU . 2.4 tm? -169.72 -45.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.424 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . 0.57 ' HG2' ' H ' ' A' ' 195' ' ' ASN . 70.8 tt0 -68.77 -133.33 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.175 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.707 HD21 ' H ' ' A' ' 196' ' ' GLN . 0.0 OUTLIER -176.15 -39.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.707 ' H ' HD21 ' A' ' 195' ' ' ASN . 12.0 mm100 -72.09 129.81 39.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.954 0.407 . . . . 0.0 111.166 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -73.39 133.77 43.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.145 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . 0.413 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . 64.51 138.36 0.05 OUTLIER Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 32.4 Cg_exo . . . . . 0 C--O 1.25 1.079 0 C-N-CA 122.46 2.107 . . . . 0.0 112.27 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.528 -0.229 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.559 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 2.1 mp -63.99 -50.54 69.07 Favored Pre-proline 0 CA--C 1.533 0.315 0 O-C-N 123.026 -0.102 . . . . 0.0 111.222 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 37.3 Cg_endo -65.25 134.42 39.08 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.174 1.916 . . . . 0.0 112.125 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.74 -39.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.294 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 74.1 p -141.33 -22.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.125 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.424 ' OD1' ' HA ' ' A' ' 121' ' ' PRO . 16.3 p-10 -49.31 -40.05 33.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.354 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.31 -43.35 83.2 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 110.873 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 46.9 t -58.3 -40.19 81.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.595 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -59.11 -44.33 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.052 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.4 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 74.5 t -60.09 -50.67 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.602 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.9 95.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.529 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.84 -41.25 99.13 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.375 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.743 ' HB3' HD23 ' A' ' 184' ' ' LEU . 97.2 mt -67.79 -44.39 77.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.789 0.328 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 65.7 mm-40 -62.82 -47.61 82.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.713 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.65 -42.65 97.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.436 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -59.0 -52.05 67.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.674 0.273 . . . . 0.0 111.159 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.548 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 52.7 tp -52.15 -43.08 63.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.123 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.99 86.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.218 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.452 HD11 HG22 ' A' ' 137' ' ' ILE . 69.9 mt -60.05 -51.37 73.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.585 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.445 ' HG3' ' HE3' ' A' ' 176' ' ' LYS . 5.1 mp0 -60.57 -37.45 81.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.4 mt -59.67 -44.95 93.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.782 0.325 . . . . 0.0 111.06 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -67.91 -46.83 70.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.391 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.01 -46.66 95.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.481 -179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.491 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 64.0 tttm -62.68 -45.81 91.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.801 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.66 -45.88 92.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.64 -39.98 97.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.564 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.44 -42.2 92.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 110.308 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.491 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.5 mt-10 -63.58 -40.63 97.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.677 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.67 -45.04 81.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.232 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.93 -42.02 81.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 145' ' ' ALA . 88.8 mt -58.39 -44.28 88.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.302 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.2 mt-30 -64.36 -46.35 83.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.456 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.445 HG23 ' OG1' ' A' ' 157' ' ' THR . 52.1 m -62.82 -50.66 70.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.062 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.56 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.8 m-85 -65.29 -43.51 90.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.76 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -57.21 -50.9 71.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.781 0.324 . . . . 0.0 110.552 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.491 HD21 ' H ' ' A' ' 155' ' ' GLY . 0.8 OUTLIER -71.28 134.22 46.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.031 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . 0.491 ' H ' HD21 ' A' ' 154' ' ' ASN . . . -55.37 113.63 3.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.55 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 83.2 p -179.58 -52.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.821 0.344 . . . . 0.0 110.619 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.445 ' OG1' HG23 ' A' ' 151' ' ' THR . 6.7 m -74.64 -131.36 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.193 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.44 ' H ' ' CG2' ' A' ' 157' ' ' THR . 7.8 ptpp? -179.3 -41.12 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.62 0.248 . . . . 0.0 111.49 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.492 ' OD2' HD13 ' A' ' 162' ' ' LEU . 29.3 m-20 -55.8 97.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.983 0.421 . . . . 0.0 111.212 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 28.6 tpt180 -74.29 -45.56 46.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.174 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -54.84 -48.04 73.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.096 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.56 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.7 mt -60.31 -36.84 78.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.796 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.411 ' HB3' ' O ' ' A' ' 160' ' ' ARG . 47.9 tp -56.09 -44.81 79.37 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.93 -43.65 98.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.454 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 91.0 m -62.09 -41.38 98.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -59.09 -42.56 90.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.008 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -59.34 -44.93 92.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.055 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -62.08 -37.54 85.43 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.959 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.611 ' HA ' ' HE1' ' A' ' 169' ' ' MET . 0.0 OUTLIER -58.07 -44.45 87.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.83 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.478 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 51.1 tp -65.37 -40.57 93.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.158 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -59.29 -46.29 88.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.442 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -65.03 -46.05 82.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.551 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.526 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -59.79 -47.4 85.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.605 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -58.52 -42.54 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.598 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.416 ' O ' HD11 ' A' ' 179' ' ' ILE . 90.2 m -58.81 -50.6 73.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.744 0.307 . . . . 0.0 111.293 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.445 ' HE3' ' HG3' ' A' ' 138' ' ' GLU . 52.5 mtmt -57.7 -40.84 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.028 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.526 HG13 ' O ' ' A' ' 173' ' ' SER . 73.1 mt -61.58 -38.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.321 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.65 -50.55 72.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.389 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.416 HD11 ' O ' ' A' ' 175' ' ' THR . 2.0 mp -64.87 -50.14 76.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.332 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.46 ' O ' HD21 ' A' ' 184' ' ' LEU . 66.1 mt -59.14 -43.22 88.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.868 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.487 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.1 tpt180 -54.83 -43.11 72.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.596 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.0 -44.95 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.606 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -61.97 -36.18 80.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.94 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.743 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.6 mm? -69.25 -41.98 76.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.425 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 79.3 mtp180 -58.09 -51.8 68.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -63.35 -36.31 83.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.159 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.27 -44.36 96.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 84.7 mt -64.09 -43.28 95.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.211 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.1 mt-30 -59.9 -46.55 88.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.065 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.92 -43.02 99.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -62.13 -39.09 91.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.939 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -165.48 139.21 4.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.183 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 51.5 tp -171.27 129.04 0.71 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.466 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 195' ' ' ASN . 57.9 mm-40 -69.84 -147.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.112 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.434 ' HB3' ' O ' ' A' ' 194' ' ' GLU . 45.8 t30 72.51 -57.72 0.62 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.522 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.414 HE21 HD21 ' A' ' 195' ' ' ASN . 98.3 mm-40 -68.79 132.16 46.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -66.61 135.05 53.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 64.95 138.26 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.209 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.45 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo . . . . . 0 C--O 1.25 1.077 0 C-N-CA 122.585 2.19 . . . . 0.0 112.282 -179.945 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.8 mp 56.32 89.48 0.1 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.714 0.292 . . . . 0.0 110.702 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -65.39 -145.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.744 2.296 . . . . 0.0 112.71 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.13 -122.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.395 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.418 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 61.7 p 55.98 -144.81 0.65 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 122.527 0.331 . . . . 0.0 111.407 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.3 p30 45.25 34.29 1.41 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.324 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 123' ' ' THR . 99.6 mt -98.78 -42.27 7.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.7 t -57.74 -44.78 86.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.316 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.515 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 21.3 tpp180 -61.51 -47.27 86.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.208 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.59 -49.45 84.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.586 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.45 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.409 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.487 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.66 -42.33 99.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.394 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.753 ' HB3' HD23 ' A' ' 184' ' ' LEU . 83.2 mt -66.5 -44.19 83.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 0.0 110.954 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -64.26 -47.1 80.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.967 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.621 ' HB2' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -57.53 -42.12 82.24 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.596 0.236 . . . . 0.0 110.944 -179.482 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.512 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 3.4 mm100 -59.15 -43.68 92.08 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.798 0.332 . . . . 0.0 110.518 179.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.768 HD22 HG23 ' A' ' 180' ' ' ILE . 89.9 mt -60.04 -40.93 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.005 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.54 -47.37 86.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.164 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -58.78 -38.93 75.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.811 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.73 ' HB3' HD12 ' A' ' 177' ' ' ILE . 4.9 mm-40 -59.44 -46.58 88.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.235 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.4 mt -59.76 -39.81 86.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.274 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -61.46 -47.77 84.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.138 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.4 -47.1 68.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.503 ' HE3' ' HD3' ' A' ' 174' ' ' LYS . 87.2 tttt -58.45 -49.51 77.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.191 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -59.71 -43.68 94.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.562 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.676 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -58.09 -41.38 94.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.367 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.464 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.36 -40.97 94.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.056 0.455 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 56.6 mt-10 -62.75 -40.02 95.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.469 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.676 HD21 ' HA3' ' A' ' 144' ' ' GLY . 80.2 m-20 -58.03 -45.44 86.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.756 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.436 ' HB2' ' HE1' ' A' ' 148' ' ' MET . 44.3 mtm -64.78 -47.23 78.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.938 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.5 mt -55.21 -45.58 77.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.03 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.4 mt-30 -64.54 -40.8 96.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.781 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.405 HG21 ' OG1' ' A' ' 157' ' ' THR . 85.1 m -60.33 -45.57 92.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.242 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.756 ' HA ' ' HG1' ' A' ' 157' ' ' THR . 2.0 m-30 -66.29 -44.53 83.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.936 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 80.0 p -66.13 -24.17 66.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.017 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -50.93 -63.15 1.22 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.41 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 160.49 -48.72 0.38 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.309 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -60.11 -71.11 0.14 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.672 0.272 . . . . 0.0 111.252 -179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.756 ' HG1' ' HA ' ' A' ' 152' ' ' TYR . 76.2 p -73.01 136.94 45.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.617 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -147.85 40.19 0.97 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.642 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.31 118.95 12.07 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -73.69 -45.0 55.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.719 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . 0.471 ' HD2' ' N ' ' A' ' 161' ' ' LYS . 0.7 OUTLIER -56.98 -51.41 69.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.325 -179.488 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.485 HD21 ' HH ' ' A' ' 152' ' ' TYR . 10.4 mp -70.57 -31.66 68.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.589 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.59 -52.02 66.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.837 0.351 . . . . 0.0 110.417 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.73 -39.38 93.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.014 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.411 ' O ' ' HG2' ' A' ' 169' ' ' MET . 92.7 m -58.48 -39.94 81.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.669 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.59 94.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.777 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -56.89 -44.47 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.293 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.3 tp60 -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.291 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.445 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 77.9 mmm -63.03 -49.96 72.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.138 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 3.2 tm? -58.03 -46.6 85.05 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.609 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -64.94 -40.87 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.179 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.2 -47.63 85.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.31 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -60.27 -44.32 95.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.154 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.597 ' HZ3' ' HB3' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.93 -42.16 84.28 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.202 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.2 m -60.45 -47.26 86.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.143 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 180' ' ' ILE . 47.3 mmtm -62.21 -43.16 99.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.932 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.73 HD12 ' HB3' ' A' ' 138' ' ' GLU . 59.9 mt -60.83 -44.14 97.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -56.41 -43.39 79.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.912 0.387 . . . . 0.0 110.334 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.493 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 68.2 mt -61.73 -44.8 99.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.819 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.768 HG23 HD22 ' A' ' 135' ' ' LEU . 70.2 mt -61.08 -45.81 97.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.436 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 29.2 tpt180 -53.71 -46.98 70.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.77 0.319 . . . . 0.0 110.813 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.6 mmt -59.24 -38.94 81.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.288 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 84.7 mt-30 -64.85 -36.34 84.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.028 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.753 HD23 ' HB3' ' A' ' 131' ' ' LEU . 9.4 mt -60.19 -50.87 71.97 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.185 0.517 . . . . 0.0 110.818 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.427 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 99.3 mtt180 -61.64 -45.82 92.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.14 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -66.44 -33.85 76.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.208 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.52 93.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.765 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 31.9 tp -72.55 -47.38 48.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 14.1 pt20 -58.15 -49.29 77.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.72 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -64.34 -42.73 96.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.407 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.16 -36.39 81.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.94 0.4 . . . . 0.0 110.521 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -168.46 140.31 2.78 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.87 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -168.89 47.22 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.481 . . . . 0.0 110.098 179.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -72.44 -50.52 25.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.975 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -68.43 136.53 53.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -60.48 139.16 57.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.011 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.27 129.2 39.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -175.85 55.86 0.14 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.212 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--O 1.249 1.029 0 C-N-CA 122.392 2.061 . . . . 0.0 112.352 -179.978 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 46.5 mm -64.11 122.62 78.58 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.61 0.243 . . . . 0.0 111.176 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.03 -45.15 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.474 2.116 . . . . 0.0 111.998 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.35 129.12 0.45 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.936 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 92.4 m -165.21 -36.17 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -57.89 -39.02 76.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.585 HD11 ' N ' ' A' ' 126' ' ' SER . 3.8 pp -56.92 -31.74 65.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.585 ' N ' HD11 ' A' ' 125' ' ' LEU . 49.6 m -60.1 -42.18 94.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -59.97 -47.02 87.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.705 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -63.14 -40.04 87.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.974 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.39 98.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.795 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -64.34 -46.94 89.25 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.702 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.541 ' HB3' HD23 ' A' ' 184' ' ' LEU . 79.6 mt -66.86 -41.13 87.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.997 0.427 . . . . 0.0 111.06 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -62.55 -48.35 79.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.795 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 64.5 pttt -60.62 -40.5 92.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.546 0.212 . . . . 0.0 111.118 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.559 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.4 mm-40 -58.55 -44.56 89.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.893 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.21 -42.2 94.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.909 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.09 -45.3 95.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.08 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.5 mt -62.26 -42.85 96.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.101 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.758 ' HB3' HD12 ' A' ' 177' ' ' ILE . 59.3 mm-40 -59.29 -45.96 89.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.327 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 139' ' ' LEU . 98.6 mt -58.72 -41.55 86.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.009 -179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -64.99 -45.74 84.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.164 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.1 t -65.2 -46.08 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.484 -179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.479 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -63.69 -47.15 82.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.102 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.62 HE21 HD22 ' A' ' 147' ' ' ASN . 70.7 tp60 -60.71 -45.27 94.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -65.77 -35.18 90.6 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.421 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.559 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.23 -43.64 81.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.993 0.425 . . . . 0.0 110.53 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.479 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.8 mt-10 -60.94 -41.18 95.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.784 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.62 HD22 HE21 ' A' ' 143' ' ' GLN . 3.7 m120 -59.0 -46.14 88.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.636 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.466 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 83.3 mtp -63.44 -47.07 83.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.921 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.559 HG13 ' O ' ' A' ' 145' ' ' ALA . 83.1 mt -53.01 -47.92 53.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.987 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.42 -35.88 80.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.121 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.548 HG21 HG22 ' A' ' 157' ' ' THR . 98.8 m -58.18 -52.7 64.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.064 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.622 ' HB2' HD11 ' A' ' 163' ' ' LEU . 21.3 m-85 -74.67 -47.34 32.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.706 0.288 . . . . 0.0 111.377 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' SER . . . . . 0.484 ' HG ' HD23 ' A' ' 163' ' ' LEU . 53.1 m -62.14 131.8 50.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.39 . . . . 0.0 111.442 -179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 55.37 44.34 27.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.66 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 173.69 128.74 1.1 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.08 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 80.0 p -69.78 140.85 53.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.607 0.241 . . . . 0.0 110.385 179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.548 HG22 HG21 ' A' ' 151' ' ' THR . 5.8 t -169.15 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.751 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.709 ' HG2' ' H ' ' A' ' 159' ' ' ASP . 4.1 ttmp? -170.67 -179.77 3.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.62 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.709 ' H ' ' HG2' ' A' ' 158' ' ' LYS . 60.1 m-20 -54.55 142.36 28.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.107 0.479 . . . . 0.0 111.926 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 39.7 mmt180 -64.24 -22.15 66.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.13 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -52.8 -42.23 64.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.063 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.455 ' HB2' ' CE2' ' A' ' 152' ' ' TYR . 3.6 mm? -65.55 -40.0 92.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.601 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.622 HD11 ' HB2' ' A' ' 152' ' ' TYR . 56.0 tp -57.22 -44.53 83.82 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.542 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.421 ' HA ' HD21 ' A' ' 164' ' ' LEU . 92.4 mt -61.38 -41.25 96.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.248 179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.1 m -59.56 -42.95 93.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.588 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.94 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.711 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.37 -45.82 90.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -38.78 88.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.454 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.479 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 73.3 mtp -59.94 -48.36 82.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.032 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.508 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 57.2 tp -58.42 -46.2 86.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.256 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.87 -43.96 94.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.259 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.69 -45.78 92.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.164 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.561 ' HA ' ' NZ ' ' A' ' 176' ' ' LYS . 80.8 p -61.04 -45.55 94.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.89 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.508 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 58.2 mtpt -59.89 -38.66 82.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.018 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.8 m -58.61 -48.05 82.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.963 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.561 ' NZ ' ' HA ' ' A' ' 173' ' ' SER . 37.3 mtmm -63.53 -40.54 97.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.876 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.758 HD12 ' HB3' ' A' ' 138' ' ' GLU . 59.2 mt -60.32 -40.16 83.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.209 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.92 -47.35 85.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 63.1 mt -62.73 -48.59 87.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.016 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.496 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 64.5 mt -60.68 -40.09 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.605 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -53.87 -45.14 70.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.352 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.52 -39.85 92.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.186 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -62.05 -43.07 99.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.145 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.541 HD23 ' HB3' ' A' ' 131' ' ' LEU . 9.3 mt -58.75 -51.15 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.104 0.478 . . . . 0.0 110.624 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 44.5 mmm-85 -57.2 -41.83 80.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.789 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 52.7 ttp85 -64.12 -37.01 85.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.414 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.12 -46.57 88.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.492 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.41 HD21 ' O ' ' A' ' 184' ' ' LEU . 4.1 mm? -65.62 -42.22 91.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.458 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.5 mt-30 -61.22 -44.06 97.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.606 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.49 -52.62 51.5 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -64.31 -45.39 88.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.786 0.327 . . . . 0.0 111.521 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -79.44 42.77 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.019 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -174.34 122.03 0.28 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.256 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 58.64 115.61 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.356 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -74.4 131.45 41.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.661 ' H ' ' NE2' ' A' ' 196' ' ' GLN . 0.0 OUTLIER -64.65 139.66 58.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.575 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.08 136.4 52.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.964 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -167.8 136.97 2.08 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.205 -179.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo . . . . . 0 C--O 1.248 1.021 0 C-N-CA 122.568 2.179 . . . . 0.0 112.318 -179.918 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.768 HD13 ' HD2' ' A' ' 121' ' ' PRO . 6.6 tp -174.13 124.1 0.4 Allowed Pre-proline 0 CA--C 1.532 0.257 0 CA-C-O 120.705 0.288 . . . . 0.0 111.029 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.768 ' HD2' HD13 ' A' ' 120' ' ' ILE . 29.6 Cg_endo -63.45 141.98 83.07 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.452 2.101 . . . . 0.0 111.904 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.06 119.45 5.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.127 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 99.1 m -167.33 -47.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.664 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.548 ' HA ' HH12 ' A' ' 127' ' ' ARG . 3.2 m120 -61.24 -36.95 81.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.976 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.9 mt -54.46 -39.52 67.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.056 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.8 t -61.12 -44.93 96.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.804 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.548 HH12 ' HA ' ' A' ' 124' ' ' ASN . 18.3 ttp-105 -66.05 -46.2 78.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.082 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.459 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 73.7 t -59.14 -50.51 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.418 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.07 85.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.269 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.819 ' HA3' ' HE3' ' A' ' 133' ' ' LYS . . . -61.14 -44.19 98.46 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.342 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 74.1 mt -66.83 -42.73 85.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.895 0.379 . . . . 0.0 110.882 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.459 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.5 mt-10 -62.86 -48.42 79.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.923 -179.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.819 ' HE3' ' HA3' ' A' ' 130' ' ' GLY . 22.7 pttp -59.48 -40.59 87.47 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.013 -179.359 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.543 HE21 ' NZ ' ' A' ' 133' ' ' LYS . 88.0 mm-40 -58.2 -44.71 88.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 110.797 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.6 mt -60.39 -44.66 95.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.29 95.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.319 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 133' ' ' LYS . 74.7 mt -59.79 -42.27 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.641 ' HB3' HD12 ' A' ' 177' ' ' ILE . 66.4 mm-40 -62.41 -41.73 98.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.369 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 98.3 mt -60.42 -40.21 90.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.372 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.55 -48.76 76.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.363 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 49.0 t -67.82 -47.29 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.484 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.4 tttm -59.36 -46.6 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.087 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.04 -46.28 89.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.645 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.569 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -60.6 -35.29 89.02 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.966 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.477 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.72 -40.5 92.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.872 0.367 . . . . 0.0 110.125 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 94.9 mt-10 -60.23 -42.44 95.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.546 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.569 HD21 ' HA3' ' A' ' 144' ' ' GLY . 77.2 m-20 -59.69 -45.89 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.835 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 88.5 mmm -67.72 -44.29 77.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.249 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.507 HG22 ' OE1' ' A' ' 167' ' ' GLN . 91.2 mt -61.8 -46.62 96.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.674 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -64.76 -42.91 94.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.816 0.341 . . . . 0.0 111.204 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.694 HG23 ' HG1' ' A' ' 157' ' ' THR . 99.5 m -63.34 -48.6 77.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.494 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.511 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 2.1 m-30 -69.15 -40.4 78.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.994 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 79.7 p -54.49 -36.78 64.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.536 -179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -158.12 133.26 8.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.95 0.405 . . . . 0.0 111.169 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.96 -141.62 12.98 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.104 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 50.0 m -71.3 -51.29 25.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.071 0.462 . . . . 0.0 110.173 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.694 ' HG1' HG23 ' A' ' 151' ' ' THR . 75.0 p -82.84 142.65 31.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.875 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 152' ' ' TYR . 18.5 ptpt -166.95 38.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.357 . . . . 0.0 111.387 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.493 ' HB3' ' HB2' ' A' ' 162' ' ' LEU . 9.9 t0 -72.53 131.06 42.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.943 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -68.29 -48.71 64.23 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.25 -49.76 76.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 0.0 110.477 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.511 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 94.1 mt -63.26 -35.5 80.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.544 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 159' ' ' ASP . 3.1 tm? -54.49 -58.04 9.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.934 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.0 mt -54.73 -37.09 65.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.4 m -57.54 -50.17 73.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.21 97.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.507 ' OE1' HG22 ' A' ' 149' ' ' ILE . 14.1 mm-40 -57.12 -44.72 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.394 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -37.57 87.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 74.5 mtp -61.15 -50.77 71.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.445 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.41 HD21 ' HE2' ' A' ' 174' ' ' LYS . 3.5 tt -64.7 -46.74 81.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.682 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . 0.446 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 8.3 tt0 -56.49 -44.55 80.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 176' ' ' LYS . 34.5 t70 -62.15 -42.12 98.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 59.9 m -59.69 -48.19 82.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.374 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.446 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 55.2 mtmt -57.22 -49.27 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 111.38 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.4 m -55.59 -46.9 77.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.296 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.496 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 53.6 mtmt -59.6 -40.94 89.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.641 HD12 ' HB3' ' A' ' 138' ' ' GLU . 65.4 mt -63.9 -38.45 82.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.015 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -57.57 -48.33 79.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.353 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.56 -40.25 83.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.36 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.543 HD12 ' HB3' ' A' ' 134' ' ' GLN . 56.5 mt -57.45 -55.59 20.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.094 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -51.21 -40.04 57.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.007 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.461 ' HE1' ' HB3' ' A' ' 182' ' ' MET . 80.6 mtp -60.03 -39.42 85.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.304 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -68.03 -43.15 79.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.405 HD11 ' N ' ' A' ' 184' ' ' LEU . 10.0 mp -62.78 -49.58 74.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.365 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.696 ' HD3' ' N ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -60.73 -36.45 78.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.724 0.297 . . . . 0.0 110.451 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.696 ' N ' ' HD3' ' A' ' 185' ' ' ARG . 22.4 tpp180 -65.28 -42.37 93.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.153 179.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.79 -37.29 86.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.787 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 24.7 tp -68.04 -48.12 66.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.064 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 12.0 mm100 -58.97 -42.69 90.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.985 0.421 . . . . 0.0 110.611 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.27 -37.17 80.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.781 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -56.12 -53.81 52.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.458 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -67.1 -28.98 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.966 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 58.0 tp -68.09 73.09 0.19 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.139 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . 0.765 ' HB2' HE22 ' A' ' 196' ' ' GLN . 24.7 pt-20 40.48 -145.19 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.564 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 19.5 p30 -174.14 -44.38 0.01 OUTLIER 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.6 0.238 . . . . 0.0 111.223 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.765 HE22 ' HB2' ' A' ' 194' ' ' GLU . 3.2 pm0 -71.52 137.56 48.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.786 0.327 . . . . 0.0 110.849 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.72 133.21 55.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 64.26 133.22 0.03 OUTLIER Pre-proline 0 C--N 1.333 -0.145 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.446 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 C--O 1.249 1.043 0 C-N-CA 122.556 2.171 . . . . 0.0 112.232 179.971 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . 0.576 ' N ' ' HB2' ' A' ' 126' ' ' SER . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.616 -0.194 . . . . 0.0 112.616 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.653 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 49.1 mm -59.42 -47.5 97.85 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 11.7 Cg_endo -55.16 154.3 23.37 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.471 2.114 . . . . 0.0 112.264 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 68.83 47.64 0.8 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.288 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 82.6 p 49.75 45.44 24.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.979 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 55.56 58.59 4.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.242 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 pp -53.38 -24.83 13.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.257 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' SER . . . . . 0.576 ' HB2' ' N ' ' A' ' 119' ' ' GLY . 43.4 t -56.08 -46.54 78.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.255 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -60.44 -44.71 95.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.949 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.448 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 50.8 t -59.68 -44.02 92.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.11 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -62.55 -41.18 98.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.099 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.49 -39.77 97.78 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.821 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.656 ' O ' ' HG2' ' A' ' 134' ' ' GLN . 84.8 mt -70.71 -38.74 73.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.722 0.296 . . . . 0.0 111.192 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 49.6 mt-10 -67.28 -48.31 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.486 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -63.45 -41.71 98.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.187 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.656 ' HG2' ' O ' ' A' ' 131' ' ' LEU . 1.5 pt20 -60.41 -43.11 97.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.897 0.38 . . . . 0.0 110.206 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.438 ' O ' HD12 ' A' ' 135' ' ' LEU . 3.0 tm? -54.25 -42.16 69.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.435 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -64.76 -37.04 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.765 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.551 ' CD1' ' HA ' ' A' ' 134' ' ' GLN . 69.0 mt -53.37 -49.46 53.31 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.72 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.562 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -61.69 -45.96 91.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.535 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.47 -38.21 71.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.379 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 98.3 mttt -63.45 -51.37 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.254 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.9 t -64.92 -44.18 96.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.246 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.437 ' HZ2' ' HZ1' ' A' ' 174' ' ' LYS . 62.7 tttp -59.23 -46.14 89.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -61.72 -42.3 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.869 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.58 -41.13 97.14 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.586 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.63 -44.59 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 110.293 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 50.3 mt-10 -60.19 -40.27 89.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -57.93 -47.95 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.439 ' HE1' ' HB1' ' A' ' 166' ' ' ALA . 60.3 mtm -67.94 -42.32 81.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.262 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.586 HG13 ' O ' ' A' ' 145' ' ' ALA . 96.2 mt -53.93 -46.88 64.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 95.4 mm-40 -65.2 -39.77 93.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.184 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.6 m -64.68 -46.25 83.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.902 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.708 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.9 m-85 -65.91 -42.15 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.985 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 88.0 p -52.03 -43.64 63.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.59 0.233 . . . . 0.0 110.897 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . 0.48 HD21 ' N ' ' A' ' 155' ' ' GLY . 0.7 OUTLIER -175.46 124.95 0.23 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.848 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . 0.48 ' N ' HD21 ' A' ' 154' ' ' ASN . . . 168.67 -56.28 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.691 179.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.3 t -179.86 45.13 0.0 OUTLIER 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.814 0.34 . . . . 0.0 110.649 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.468 HG21 ' HA ' ' A' ' 152' ' ' TYR . 9.2 t -175.34 159.28 2.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -149.31 24.65 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.078 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.83 71.83 2.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.182 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 38.8 ttm180 -53.42 -30.22 39.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.903 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . 0.466 ' C ' ' HD3' ' A' ' 161' ' ' LYS . 7.3 tmtm? -53.28 -55.48 24.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.015 0.436 . . . . 0.0 109.964 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.708 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 92.9 mt -64.27 -32.68 74.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.216 179.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.558 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 47.8 tp -56.33 -51.9 66.55 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.31 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.58 -42.85 79.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.4 m -56.55 -41.79 77.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.202 0.525 . . . . 0.0 109.661 178.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . 0.439 ' HB1' ' HE1' ' A' ' 148' ' ' MET . . . -69.74 -37.51 76.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.507 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.558 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 14.2 mm100 -56.45 -44.35 80.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.138 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.0 tp60 -65.69 -40.19 92.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.124 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.421 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.8 mtp -56.73 -47.58 79.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.989 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.457 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 54.5 tp -60.32 -45.49 93.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.323 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.68 -47.05 87.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.037 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.19 -40.8 97.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.812 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 177' ' ' ILE . 48.8 m -59.97 -45.87 91.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.909 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.5 mtpp -58.84 -41.25 86.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.977 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.6 m -58.77 -44.32 90.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.739 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -62.58 -41.53 99.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.562 HG12 ' HB3' ' A' ' 138' ' ' GLU . 62.1 mt -58.56 -42.9 85.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.2 m-20 -61.44 -41.01 96.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.33 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.86 -44.12 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.127 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.531 HG21 HD22 ' A' ' 184' ' ' LEU . 53.5 mt -58.74 -48.79 84.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.806 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.45 ' HE ' ' HA ' ' A' ' 178' ' ' ASP . 84.8 mtm180 -53.96 -40.8 67.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.563 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 25.8 mmt -60.05 -46.54 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.565 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.4 -41.98 90.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.911 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -61.05 -42.31 98.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.201 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.42 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 71.3 mtt-85 -58.01 -51.27 70.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.459 ' HD3' ' O ' ' A' ' 182' ' ' MET . 10.5 mpt_? -66.04 -36.81 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.812 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -59.46 -42.72 92.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 94.1 mt -63.84 -44.0 94.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.732 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -60.86 -45.26 95.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.207 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -61.65 -47.51 85.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.35 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -62.78 -44.28 96.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.011 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -78.3 43.4 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.468 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -174.05 127.56 0.37 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.377 179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -153.66 -144.42 0.15 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.564 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -68.77 137.94 54.42 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.768 0.318 . . . . 0.0 110.921 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.648 ' H ' ' NE2' ' A' ' 196' ' ' GLN . 0.0 OUTLIER -58.71 138.04 57.28 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.814 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.38 133.51 55.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.136 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -64.24 137.84 97.24 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo . . . . . 0 C--O 1.248 1.005 0 C-N-CA 122.595 2.197 . . . . 0.0 112.163 179.952 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.151 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.539 ' N ' ' HD3' ' A' ' 121' ' ' PRO . 31.3 pt 37.75 56.4 4.31 Favored Pre-proline 0 N--CA 1.466 0.335 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.539 ' HD3' ' N ' ' A' ' 120' ' ' ILE . 21.4 Cg_exo -65.41 -142.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.571 2.181 . . . . 0.0 112.194 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.78 -57.02 7.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.096 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 82.1 p -78.68 117.35 19.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.042 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 44.0 t30 177.41 -48.15 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.104 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.55 -45.3 94.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.571 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.4 t -62.26 -45.72 92.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.517 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.556 ' HG2' HD13 ' A' ' 131' ' ' LEU . 39.3 ttm180 -63.81 -45.21 90.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.565 -179.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.27 -48.28 89.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.677 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.97 95.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.569 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.577 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -65.07 -48.53 69.75 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.909 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.725 HD11 HD12 ' A' ' 184' ' ' LEU . 90.3 mt -64.94 -41.59 95.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.924 0.393 . . . . 0.0 111.31 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -61.09 -51.09 70.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.864 -179.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.8 ptmm? -59.48 -39.21 83.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.239 -179.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.577 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.5 mm-40 -58.21 -44.44 88.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.713 0.292 . . . . 0.0 110.999 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.8 mt -58.77 -44.13 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.306 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.75 84.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.436 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.09 -42.49 86.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.354 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.7 mm-40 -60.06 -43.44 95.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.32 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 88.5 mt -58.42 -43.07 88.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.051 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -59.77 -48.45 81.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.508 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.8 t -68.61 -46.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.496 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 37.4 ttmt -59.25 -49.23 78.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.399 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -63.36 -42.34 98.88 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.809 0.338 . . . . 0.0 110.784 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.79 -39.16 94.99 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.947 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.519 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -64.63 -40.05 94.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.106 0.479 . . . . 0.0 109.92 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.606 ' OE2' HD23 ' A' ' 170' ' ' LEU . 64.8 mm-40 -59.81 -39.42 84.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.341 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.61 -44.05 96.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.231 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 80.5 mtp -67.09 -41.31 86.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.228 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.0 mt -61.14 -49.26 85.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.667 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -68.98 -44.14 73.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.6 m -64.66 -47.09 79.75 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.752 0.311 . . . . 0.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.461 ' N ' ' HD1' ' A' ' 152' ' ' TYR . 1.4 m-30 -74.87 9.12 2.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.578 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 73.4 m -67.35 -49.4 64.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.641 0.258 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -157.44 -49.87 0.07 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -64.93 144.38 48.01 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.367 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.0 t 61.45 -117.1 0.67 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.282 0.087 . . . . 0.0 110.853 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 89.5 m -51.27 128.57 22.58 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.923 0.392 . . . . 0.0 111.252 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -102.48 -37.78 7.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.051 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -55.15 111.92 0.96 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.476 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.764 ' HG3' HD21 ' A' ' 163' ' ' LEU . 55.2 ttp180 -74.85 -12.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.092 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -52.58 -50.3 63.26 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.435 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.482 HD11 ' HA ' ' A' ' 162' ' ' LEU . 3.7 mm? -67.24 -33.85 76.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.001 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.764 HD21 ' HG3' ' A' ' 160' ' ' ARG . 61.1 tp -56.57 -44.62 81.15 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.418 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.98 -44.82 91.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.606 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 88.1 m -58.98 -43.12 91.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.916 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -60.47 -41.23 93.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -59.14 -42.76 91.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.164 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -59.22 -41.22 88.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.436 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.465 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 71.6 mmm -56.42 -45.98 80.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.624 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.606 HD23 ' OE2' ' A' ' 146' ' ' GLU . 56.9 tp -58.28 -44.64 88.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.047 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -58.45 -43.75 88.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.382 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.48 -47.2 87.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.255 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 80.5 p -64.48 -45.41 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.541 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 29.4 mtpp -57.17 -44.16 83.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.48 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' THR . . . . . 0.44 ' O ' HD11 ' A' ' 179' ' ' ILE . 85.9 m -59.16 -50.16 75.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 111.047 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -59.21 -42.25 90.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.869 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.538 HG13 ' O ' ' A' ' 173' ' ' SER . 59.3 mt -62.07 -34.6 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.028 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -61.2 -50.75 71.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.662 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . 0.44 HD11 ' O ' ' A' ' 175' ' ' THR . 1.8 mp -62.79 -47.23 93.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.507 HG21 HD22 ' A' ' 184' ' ' LEU . 70.4 mt -58.51 -44.15 88.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.763 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.416 ' HG3' HH11 ' A' ' 181' ' ' ARG . 29.9 tpt85 -53.81 -42.81 68.78 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.345 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.78 -38.9 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.5 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -64.15 -45.22 89.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.042 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.725 HD12 HD11 ' A' ' 131' ' ' LEU . 4.4 mm? -61.67 -53.17 59.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.623 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.488 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 16.0 ptp180 -57.69 -39.55 77.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.63 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -63.28 -39.94 96.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.703 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -61.9 -44.12 97.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.218 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.508 HD11 ' N ' ' A' ' 188' ' ' LEU . 10.1 mp -65.87 -41.84 91.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.441 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 12.3 mm100 -61.53 -45.92 92.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.748 0.309 . . . . 0.0 111.161 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.51 -49.78 65.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.782 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -65.88 -58.62 5.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.17 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -69.76 121.36 17.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.021 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . 0.55 HD21 ' N ' ' A' ' 194' ' ' GLU . 0.9 OUTLIER 179.88 -133.3 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . 0.55 ' N ' HD21 ' A' ' 193' ' ' LEU . 23.9 pt-20 -170.8 -45.29 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.766 0.317 . . . . 0.0 110.518 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.49 HD21 ' N ' ' A' ' 196' ' ' GLN . 0.7 OUTLIER -178.91 128.91 0.11 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.301 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.49 ' N ' HD21 ' A' ' 195' ' ' ASN . 3.3 pp0? -64.75 142.89 58.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.189 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.96 133.89 56.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.04 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -172.91 138.44 0.85 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.053 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo . . . . . 0 C--O 1.249 1.06 0 C-N-CA 122.549 2.166 . . . . 0.0 112.226 179.797 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.593 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 68.1 mt -60.05 -49.53 90.61 Favored Pre-proline 0 CA--C 1.533 0.307 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.593 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 25.9 Cg_endo -62.07 141.54 89.17 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.268 1.979 . . . . 0.0 112.189 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 66.69 148.37 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.337 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.9 m 66.4 53.29 1.0 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.761 -179.677 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -171.91 129.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.519 179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.4 mt -152.71 -132.23 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.913 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.0 p -52.96 -36.1 59.69 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.43 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.452 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 47.6 ttm-85 -57.49 -49.41 76.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.157 -179.744 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.63 -52.05 55.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.894 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.19 -39.27 75.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.374 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.57 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.84 -44.6 97.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.481 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.696 ' HB3' HD12 ' A' ' 184' ' ' LEU . 87.9 mt -66.51 -47.59 72.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.015 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -57.31 -49.15 77.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.676 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.584 ' HB2' ' NZ ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -59.96 -36.03 76.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.608 0.242 . . . . 0.0 110.833 -179.731 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.57 ' HB3' HD12 ' A' ' 180' ' ' ILE . 90.5 mm-40 -57.57 -49.29 76.86 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.677 0.275 . . . . 0.0 110.862 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.487 HD21 ' O ' ' A' ' 131' ' ' LEU . 4.3 mm? -58.98 -38.44 79.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.981 0.419 . . . . 0.0 110.968 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.44 83.97 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.743 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.5 mt -65.3 -50.7 71.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.759 -179.414 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.509 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -55.0 -46.53 75.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.808 -179.441 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.8 mt -62.3 -41.07 98.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.721 0.296 . . . . 0.0 110.866 179.889 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -62.21 -44.62 96.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.692 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -64.91 -43.69 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.974 179.838 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.545 ' HG3' HD23 ' A' ' 170' ' ' LEU . 87.3 tttt -60.62 -45.68 93.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.624 179.804 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -62.69 -45.9 90.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.464 179.616 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.617 ' HA3' HD21 ' A' ' 147' ' ' ASN . . . -60.3 -37.7 93.46 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.124 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.38 93.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.077 0.465 . . . . 0.0 110.014 179.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -62.84 -46.29 88.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.283 179.324 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.617 HD21 ' HA3' ' A' ' 144' ' ' GLY . 75.5 m-20 -55.89 -40.52 73.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.109 179.346 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.525 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.6 mmm -61.87 -47.31 85.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.747 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 68.9 mt -56.31 -50.84 69.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.929 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.85 -38.72 82.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.495 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.3 m -58.25 -45.93 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -69.79 -36.67 75.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.31 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 43.7 t -52.02 -49.55 63.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.752 -179.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 -71.35 137.19 48.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.661 179.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -59.24 105.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.298 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.3 t 178.43 -42.88 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.865 0.364 . . . . 0.0 110.604 -179.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 60.2 p -148.13 47.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.7 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -78.35 50.15 0.91 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.345 -179.618 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 162' ' ' LEU . 1.5 m-20 -62.05 132.83 54.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 22.8 tpp180 -73.1 -54.86 7.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.608 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -64.23 -48.55 75.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.691 -179.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 159' ' ' ASP . 90.2 mt -59.12 -40.75 86.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.37 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.434 ' HA ' HD11 ' A' ' 163' ' ' LEU . 51.7 tp -60.57 -42.78 97.33 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.408 179.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 160' ' ' ARG . 97.3 mt -55.33 -41.26 72.19 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.022 0.439 . . . . 0.0 109.95 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.404 ' O ' ' HG2' ' A' ' 169' ' ' MET . 89.4 m -60.38 -45.02 95.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.89 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.76 -45.47 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.395 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -56.13 -44.36 79.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 98.2 mm-40 -62.37 -38.04 88.03 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.452 179.13 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.463 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.5 mmm -62.39 -46.09 90.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.132 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.545 HD23 ' HG3' ' A' ' 142' ' ' LYS . 3.2 tm? -58.97 -46.76 87.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.784 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.54 -43.13 85.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.172 -179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -60.98 -45.07 96.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.082 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.524 ' O ' HG13 ' A' ' 177' ' ' ILE . 85.1 p -58.46 -45.31 88.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.871 -179.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -57.17 -42.67 81.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.754 179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 79.7 m -59.57 -44.36 93.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.585 179.623 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.458 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.2 mtpp -61.08 -41.92 97.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.48 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 173' ' ' SER . 64.4 mt -58.53 -41.02 80.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.836 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.41 -46.09 91.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.369 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.11 -46.16 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.437 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.57 HD12 ' HB3' ' A' ' 134' ' ' GLN . 69.8 mt -59.17 -40.61 81.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.29 179.28 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -55.24 -42.55 73.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.375 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -61.75 -40.47 95.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.459 179.408 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -64.44 -41.65 96.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.696 HD12 ' HB3' ' A' ' 131' ' ' LEU . 4.5 mm? -64.38 -50.95 65.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.595 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 15.7 ptp180 -57.86 -44.74 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.654 0.264 . . . . 0.0 111.166 -179.344 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -64.44 -41.46 96.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.343 . . . . 0.0 110.953 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -61.94 -45.21 94.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.001 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.574 ' O ' ' HG2' ' A' ' 192' ' ' GLN . 92.5 mt -60.46 -45.57 93.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 98.7 mm-40 -57.39 -38.28 74.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.026 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.18 85.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.427 -179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.14 -52.24 56.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.322 -179.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.574 ' HG2' ' O ' ' A' ' 188' ' ' LEU . 25.0 pt20 -70.77 134.57 47.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.971 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -175.99 129.7 0.24 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.932 179.867 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -174.26 134.52 0.42 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.13 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . 0.494 HD21 ' N ' ' A' ' 196' ' ' GLN . 0.8 OUTLIER 63.61 126.61 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.177 179.682 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . 0.494 ' N ' HD21 ' A' ' 195' ' ' ASN . 3.1 pt20 -68.28 131.91 46.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -64.28 139.43 58.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.219 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 61.06 62.48 2.75 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.419 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.598 2.199 . . . . 0.0 112.218 -179.99 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 112.584 -0.206 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.592 HD13 ' HB3' ' A' ' 124' ' ' ASN . 10.9 tt -61.17 129.03 90.34 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.581 0.229 . . . . 0.0 111.116 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.437 ' HG2' ' H ' ' A' ' 122' ' ' ALA . 45.7 Cg_endo -69.81 -69.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.223 1.949 . . . . 0.0 112.422 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.437 ' H ' ' HG2' ' A' ' 121' ' ' PRO . . . 179.36 -54.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.204 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.3 p -83.39 33.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.506 -179.775 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.592 ' HB3' HD13 ' A' ' 120' ' ' ILE . 44.0 t30 -76.34 -42.45 44.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.868 179.741 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.42 ' HA ' HD21 ' A' ' 125' ' ' LEU . 93.6 mt -58.59 -43.2 89.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.056 -179.934 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 81.0 p -64.84 -42.39 94.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 19.7 ttm105 -62.49 -47.71 82.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.299 -179.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.04 -49.82 73.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.978 -179.429 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.01 95.86 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 -179.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.514 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.09 -51.44 56.86 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.796 -179.619 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.639 ' HB3' HD12 ' A' ' 184' ' ' LEU . 88.7 mt -65.77 -38.2 88.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.845 0.355 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -62.06 -49.07 77.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.916 -179.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.489 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 65.9 pttt -61.72 -40.76 96.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.045 -179.377 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.5 mm100 -58.56 -44.93 89.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.747 0.308 . . . . 0.0 110.836 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 98.6 mt -62.53 -36.4 82.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.136 0.494 . . . . 0.0 111.041 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . 0.59 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -67.4 -48.57 66.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.433 -179.786 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.46 -47.33 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.936 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.522 ' CG ' HG12 ' A' ' 177' ' ' ILE . 12.2 pt-20 -58.28 -39.61 79.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.15 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.475 ' HG ' ' N ' ' A' ' 140' ' ' LYS . 0.2 OUTLIER -70.18 -39.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.53 -179.925 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.59 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 68.4 mttm -59.34 -48.04 83.14 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.818 0.342 . . . . 0.0 110.735 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.46 -40.89 87.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.1 tttm -59.67 -44.49 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.737 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -65.24 -42.38 93.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.56 -40.94 95.22 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.476 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.459 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.64 -40.65 92.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.307 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.27 -39.78 94.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 179.507 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.06 -44.13 91.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.492 179.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.88 -45.67 88.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.088 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 145' ' ' ALA . 68.4 mt -57.88 -47.06 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.33 -47.58 73.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.765 -179.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 92.6 m -61.26 -47.84 84.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.898 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . 0.597 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.5 m-85 -66.35 -26.07 67.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.997 -179.292 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 68.4 m -47.14 -40.69 16.19 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.799 0.333 . . . . 0.0 110.771 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -171.37 118.51 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.867 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 146.14 -141.56 9.75 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.675 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.6 t -80.59 143.05 33.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.243 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 17.6 m 61.53 48.41 5.84 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 179.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -82.26 39.82 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.101 179.848 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.06 133.04 49.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.92 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 43.6 mmm-85 -73.09 -41.13 64.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.63 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -55.57 -53.35 57.56 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.293 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.597 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 93.0 mt -64.38 -34.92 79.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.91 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 56.8 tp -55.28 -48.93 73.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.759 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.41 -42.33 98.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.397 179.681 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.8 m -59.02 -42.03 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.972 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.4 94.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.5 -44.64 85.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.273 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -61.33 -40.38 94.0 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.475 179.241 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.412 ' HB3' ' HE1' ' A' ' 169' ' ' MET . 72.9 mtp -58.77 -47.66 83.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.441 179.292 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.441 ' CD2' ' HE3' ' A' ' 174' ' ' LYS . 2.0 tt -60.87 -40.69 93.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.963 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -59.49 -41.46 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 179.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -61.68 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.839 179.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 177' ' ' ILE . 94.1 p -59.1 -40.21 84.64 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.384 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.441 ' HE3' ' CD2' ' A' ' 170' ' ' LEU . 99.6 mttt -57.29 -44.19 83.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.388 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.2 m -59.82 -48.13 82.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.36 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.576 ' NZ ' ' HB3' ' A' ' 176' ' ' LYS . 3.4 mmmp? -62.28 -47.32 84.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.992 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.522 HG12 ' CG ' ' A' ' 138' ' ' GLU . 60.6 mt -57.62 -46.31 86.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.71 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -58.84 -47.3 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.663 0.268 . . . . 0.0 111.532 -179.56 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.65 -50.58 75.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.9 -179.417 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.535 HG21 HD22 ' A' ' 184' ' ' LEU . 66.0 mt -61.3 -44.41 98.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 19.4 mmt85 -56.22 -40.83 74.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.805 0.336 . . . . 0.0 110.509 179.602 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.43 ' HB2' ' HE1' ' A' ' 182' ' ' MET . 50.0 tpp -59.96 -43.4 95.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.272 179.291 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.94 -40.29 97.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.679 179.517 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.639 HD12 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -62.25 -44.24 96.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.685 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.424 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 78.0 mtp180 -57.6 -43.9 85.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.619 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.422 ' HG3' HH11 ' A' ' 186' ' ' ARG . 43.0 mmm-85 -62.33 -42.26 99.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.96 93.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.036 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 86.0 mt -61.73 -45.81 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.123 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -60.39 -41.87 94.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.082 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.25 -47.62 81.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.543 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -63.67 -59.74 4.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.93 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -95.52 118.4 32.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.87 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.64 49.7 1.86 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.517 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -71.39 134.21 46.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.845 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -66.21 -48.8 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.805 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.73 140.88 51.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.637 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.75 136.3 55.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.276 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -60.17 136.26 91.13 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.055 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo . . . . . 0 C--O 1.249 1.036 0 C-N-CA 122.547 2.165 . . . . 0.0 112.238 -179.976 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.465 -0.254 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.454 HD13 ' O ' ' A' ' 120' ' ' ILE . 2.0 pp -60.78 138.13 93.39 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.734 179.953 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.579 ' HD2' HG23 ' A' ' 123' ' ' THR . 73.2 Cg_endo -75.45 -142.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.539 2.159 . . . . 0.0 111.631 179.723 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . 0.548 ' HA ' HD22 ' A' ' 125' ' ' LEU . . . -82.3 34.0 0.41 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.953 0.406 . . . . 0.0 110.616 179.197 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' THR . . . . . 0.579 HG23 ' HD2' ' A' ' 121' ' ' PRO . 3.7 t -78.37 -39.41 39.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.64 -179.833 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 15.2 p-10 -161.22 36.12 0.14 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.548 HD22 ' HA ' ' A' ' 122' ' ' ALA . 4.4 pp -80.1 -35.54 36.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.44 179.264 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 79.5 p -67.59 -39.93 84.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.086 179.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.4 ' HG2' HH11 ' A' ' 127' ' ' ARG . 15.2 tpp85 -56.27 -59.86 4.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.119 -179.683 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.8 -41.29 75.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.772 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.24 74.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.332 179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.838 ' HA3' ' HE3' ' A' ' 133' ' ' LYS . . . -61.86 -57.79 15.88 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.132 179.652 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.748 HD22 HD13 ' A' ' 184' ' ' LEU . 6.8 mp -53.63 -46.12 70.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -58.05 -55.0 40.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.681 0.277 . . . . 0.0 111.478 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.838 ' HE3' ' HA3' ' A' ' 130' ' ' GLY . 22.3 pttp -60.79 -34.16 74.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.895 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.3 mm100 -60.64 -50.21 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.247 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 4.6 mm? -55.61 -43.5 76.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.843 0.354 . . . . 0.0 111.094 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.99 79.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 133' ' ' LYS . 68.5 mt -63.16 -42.53 96.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.581 -179.682 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.705 ' HB3' HD12 ' A' ' 177' ' ' ILE . 69.0 mm-40 -59.09 -44.88 91.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.43 -179.601 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.3 mt -60.32 -40.71 91.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.773 0.32 . . . . 0.0 111.001 -179.873 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -62.11 -50.13 73.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.493 -179.795 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.75 -49.96 64.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.993 -179.34 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.9 tttt -57.57 -44.86 85.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.338 -179.433 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.87 -51.21 70.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.493 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.39 -34.83 86.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.542 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.23 -40.95 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.983 0.42 . . . . 0.0 110.421 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -60.71 -43.72 97.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.743 179.706 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.23 -43.37 98.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.933 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.493 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 84.1 mtp -63.33 -47.26 82.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.965 179.899 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.1 mt -56.68 -47.95 81.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -65.12 -40.03 93.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.039 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.4 m -56.87 -46.03 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.627 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -71.76 -39.77 69.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.341 -179.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 67.0 p -77.12 40.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.913 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -178.57 -51.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.927 0.394 . . . . 0.0 110.64 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -65.74 155.58 50.03 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.324 179.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -49.89 -42.94 48.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.826 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 86.0 m -63.49 130.41 44.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.733 179.599 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -150.91 46.01 0.84 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . 0.531 ' HB3' ' HB2' ' A' ' 162' ' ' LEU . 64.1 t0 -59.81 132.36 53.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.287 179.876 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.533 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 30.0 tpt180 -66.9 -50.16 63.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.752 -179.135 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.9 -46.22 82.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . 0.531 ' HB2' ' HB3' ' A' ' 159' ' ' ASP . 77.3 mt -61.17 -45.85 92.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.226 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 57.3 tp -60.33 -45.65 92.68 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.0 -0.28 . . . . 0.0 111.119 -179.672 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . 0.547 ' O ' ' HB2' ' A' ' 168' ' ' GLN . 94.8 mt -57.27 -37.26 72.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.774 0.321 . . . . 0.0 110.712 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 165' ' ' THR . . . . . 0.47 ' O ' ' HG3' ' A' ' 169' ' ' MET . 88.4 m -61.81 -47.52 84.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.163 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -68.15 -49.18 62.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.446 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -56.96 -36.4 70.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 109.989 179.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . 0.547 ' HB2' ' O ' ' A' ' 164' ' ' LEU . 0.5 OUTLIER -62.21 -45.91 91.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.997 179.63 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 169' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 165' ' ' THR . 58.8 mtm -60.48 -39.33 87.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.426 ' C ' HD11 ' A' ' 170' ' ' LEU . 2.9 tm? -60.77 -42.04 96.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.437 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -64.96 -47.52 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.524 -179.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -64.08 -42.27 97.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.816 -179.356 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.531 ' O ' HG13 ' A' ' 177' ' ' ILE . 86.2 p -57.83 -47.53 82.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.33 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -60.92 -48.01 83.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.607 -179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.7 m -58.04 -48.6 79.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.707 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.476 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 54.6 mtmt -59.28 -43.64 92.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.047 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.705 HD12 ' HB3' ' A' ' 138' ' ' GLU . 72.2 mt -60.9 -35.57 65.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.183 179.919 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 182' ' ' MET . 65.2 m-20 -62.25 -49.82 74.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.686 0.279 . . . . 0.0 110.806 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 39.9 mm -62.42 -50.17 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.038 0.447 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.577 HG21 ' CD1' ' A' ' 184' ' ' LEU . 88.4 mt -55.37 -49.92 69.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.277 179.555 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.728 ' HA ' HD11 ' A' ' 184' ' ' LEU . 79.5 ttt180 -49.47 -40.27 36.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.348 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.54 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.4 mmt -57.8 -41.06 81.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.867 178.951 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -66.62 -36.91 83.73 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.057 179.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.748 HD13 HD22 ' A' ' 131' ' ' LEU . 6.8 mp -61.29 -56.95 14.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.728 0.299 . . . . 0.0 111.28 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.5 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 15.0 ptp180 -60.47 -43.23 97.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.747 -179.189 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 15.0 tpp85 -60.12 -44.97 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.803 0.335 . . . . 0.0 110.987 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.18 -43.98 93.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.479 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . 0.577 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 84.3 mt -64.13 -46.59 83.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.664 -179.421 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.5 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 87.5 mt-30 -56.81 -41.56 77.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.64 0.257 . . . . 0.0 111.436 -179.705 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -70.12 -56.51 6.69 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -75.86 -60.91 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.693 -179.043 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.47 ' HB3' ' O ' ' A' ' 188' ' ' LEU . 41.0 tt0 -68.44 140.66 55.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.187 -179.726 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 60.5 tp -172.13 130.84 0.62 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.309 179.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -57.63 -54.44 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.054 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 44.4 t30 -178.99 132.04 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.942 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -67.49 134.48 51.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.01 132.07 50.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.179 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . 0.544 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -174.52 54.68 0.15 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.273 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . 0.544 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 35.2 Cg_exo . . . . . 0 C--O 1.248 1.0 0 C-N-CA 122.413 2.075 . . . . 0.0 112.266 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.396 -0.281 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . 0.45 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 67.5 mt 64.55 132.91 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.25 0 CA-C-O 120.696 0.284 . . . . 0.0 111.168 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 26.6 Cg_exo -62.84 -135.9 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.723 2.282 . . . . 0.0 112.478 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.67 47.17 0.15 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.843 0.354 . . . . 0.0 111.043 -179.938 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 70.2 p -134.85 40.74 2.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -174.5 35.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.545 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -68.56 -40.9 80.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.332 179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.6 p -53.13 -43.5 66.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.15 -179.926 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' ARG . . . . . 0.516 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 20.7 ttm105 -63.18 -43.79 97.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.761 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.459 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 60.7 t -58.55 -45.94 90.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.995 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 179.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.703 ' HA3' ' HE2' ' A' ' 133' ' ' LYS . . . -62.09 -40.61 99.17 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.333 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.531 ' HB3' HD23 ' A' ' 184' ' ' LEU . 89.0 mt -67.34 -42.75 83.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.898 0.38 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 67.7 mm-40 -63.79 -46.8 83.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.75 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.703 ' HE2' ' HA3' ' A' ' 130' ' ' GLY . 65.9 pttt -59.98 -41.19 91.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.661 0.267 . . . . 0.0 111.229 -179.316 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.0 mm-40 -59.32 -46.24 89.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 135' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 60.0 tp -61.42 -41.93 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.844 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.88 85.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.285 -179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -59.15 -42.41 86.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.708 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . 0.564 ' HB3' HD12 ' A' ' 177' ' ' ILE . 65.0 mm-40 -61.97 -40.05 94.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.129 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.6 mt -59.8 -42.4 93.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.209 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.83 -49.19 71.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.189 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.68 -46.93 93.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.166 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 142' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.8 tttm -61.88 -44.16 97.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.629 179.961 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -58.69 -44.84 90.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.06 179.675 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 144' ' ' GLY . . . . . 0.465 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -65.16 -35.08 91.27 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 145' ' ' ALA . . . . . 0.536 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.58 -41.09 89.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.542 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.0 mt-10 -61.72 -42.54 99.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.687 179.722 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -61.99 -39.44 92.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.523 179.591 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 148' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.8 mtp -67.81 -41.49 83.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.274 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 149' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 145' ' ' ALA . 73.5 mt -63.33 -47.5 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.439 -179.564 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 150' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 3.1 pt20 -68.83 -45.36 71.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.768 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 151' ' ' THR . . . . . 0.449 ' C ' ' H ' ' A' ' 153' ' ' SER . 93.2 m -66.04 -48.35 71.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.873 -179.377 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -74.47 23.1 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.832 -179.518 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 153' ' ' SER . . . . . 0.759 ' HB2' HD12 ' A' ' 163' ' ' LEU . 37.4 t -166.06 66.98 0.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.645 0.259 . . . . 0.0 111.189 -179.724 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -160.01 -54.67 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.622 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 167.26 56.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 -179.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -160.39 -44.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.806 0.336 . . . . 0.0 111.082 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 15.3 t -68.83 -150.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.829 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -176.65 -47.28 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.77 0.319 . . . . 0.0 110.777 179.714 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -75.54 120.38 20.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 179.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 48.9 mmt-85 -74.15 -30.71 62.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.998 179.44 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -53.24 -46.78 69.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.75 -40.33 96.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.059 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 163' ' ' LEU . . . . . 0.759 HD12 ' HB2' ' A' ' 153' ' ' SER . 62.3 tp -57.43 -48.02 80.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.832 0.348 . . . . 0.0 110.578 179.739 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.9 -39.63 94.62 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.166 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.8 m -56.47 -44.61 80.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.658 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.44 -41.3 98.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 167' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.2 mt-30 -58.03 -42.53 85.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.153 179.61 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.36 -40.03 85.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.768 179.119 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.1 mtp -59.92 -47.31 86.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.634 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 170' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 3.1 tm? -57.4 -47.49 81.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.675 -179.754 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -60.59 -42.04 95.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -57.46 -46.41 83.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 173' ' ' SER . . . . . 0.51 ' O ' HG13 ' A' ' 177' ' ' ILE . 51.1 m -62.09 -42.97 99.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 -179.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 174' ' ' LYS . . . . . 0.589 ' NZ ' ' HB3' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.54 -42.99 84.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.492 -179.723 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.7 m -61.37 -48.73 79.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.406 -179.634 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 180' ' ' ILE . 68.3 mttm -62.87 -46.59 87.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.196 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 177' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 138' ' ' GLU . 54.6 mt -59.99 -40.23 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.138 -179.776 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 178' ' ' ASP . . . . . 0.491 ' O ' ' HG2' ' A' ' 182' ' ' MET . 8.2 t70 -58.03 -44.67 87.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.001 0.429 . . . . 0.0 109.99 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.99 -43.05 97.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.926 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 180' ' ' ILE . . . . . 0.505 HD12 ' HB3' ' A' ' 134' ' ' GLN . 71.3 mt -59.88 -46.78 93.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.129 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 181' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 73.1 mtt-85 -55.48 -44.2 76.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 182' ' ' MET . . . . . 0.491 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 92.2 mmm -59.69 -37.5 78.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.491 179.577 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -67.34 -38.93 85.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.089 179.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 184' ' ' LEU . . . . . 0.531 HD23 ' HB3' ' A' ' 131' ' ' LEU . 9.2 mt -60.49 -53.95 51.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.179 0.514 . . . . 0.0 110.768 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 185' ' ' ARG . . . . . 0.533 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 7.7 ptm180 -64.2 -43.02 96.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.179 -179.879 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 186' ' ' ARG . . . . . 0.588 ' HA ' ' NE2' ' A' ' 189' ' ' GLN . 46.1 ttm-85 -62.3 -36.11 81.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.129 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -65.78 -43.62 88.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.682 -179.59 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 81.9 mt -65.73 -49.32 68.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.878 -179.2 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 189' ' ' GLN . . . . . 0.588 ' NE2' ' HA ' ' A' ' 186' ' ' ARG . 16.4 pt20 -59.5 -47.49 85.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.858 0.361 . . . . 0.0 111.644 -179.601 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -67.0 -39.21 87.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.612 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.62 -32.64 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.114 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 192' ' ' GLN . . . . . 0.448 ' HG2' ' N ' ' A' ' 193' ' ' LEU . 8.2 tt0 -157.05 -116.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.471 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 193' ' ' LEU . . . . . 0.448 ' N ' ' HG2' ' A' ' 192' ' ' GLN . 60.8 tp 68.08 -65.22 0.26 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.651 0.38 . . . . 0.0 111.994 179.77 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 65.96 129.14 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.85 0.357 . . . . 0.0 111.128 -179.7 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 46.3 t30 63.67 125.73 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.133 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -74.07 139.95 45.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.248 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.81 142.51 57.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.486 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 65.78 138.5 0.05 OUTLIER Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.494 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo . . . . . 0 C--O 1.25 1.087 0 C-N-CA 122.471 2.114 . . . . 0.0 112.287 -179.933 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.921 0.391 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 84.3 t -61.2 -45.7 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.58 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.98 -43.88 97.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.47 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.71 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -60.85 -50.67 65.01 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.01 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.469 HD13 HD22 ' A' ' 184' ' ' LEU . 93.4 mt -67.26 -40.2 86.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.82 0.343 . . . . 0.0 111.427 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -62.67 -47.15 84.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.575 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.71 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.8 pttt -60.85 -41.64 96.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.598 0.237 . . . . 0.0 111.116 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 31.0 mm100 -57.42 -44.66 84.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.901 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -61.31 -41.83 97.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.403 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.46 -45.71 90.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.23 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.2 -41.32 83.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.908 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.526 ' HB3' ' CD1' ' A' ' 177' ' ' ILE . 62.1 mm-40 -57.95 -44.28 86.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.015 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.5 mt -61.3 -39.5 90.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.225 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -62.2 -47.84 82.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.5 t -72.53 -48.31 47.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.0 tttp -60.29 -54.98 39.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.158 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -61.79 -38.8 89.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.34 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.57 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.95 -40.83 98.97 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.503 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.98 -42.11 81.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 110.568 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 49.7 mt-10 -62.5 -42.32 99.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -60.61 -40.18 90.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.776 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.3 mmm -67.93 -45.25 74.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.021 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.6 mt -57.09 -49.72 78.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.659 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -63.59 -41.33 98.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.411 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 95.1 m -60.14 -44.5 94.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 162' ' ' LEU . 7.3 m-30 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 39.4 ttpt . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.976 0.417 . . . . 0.0 110.571 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.552 ' HB3' ' CE2' ' A' ' 152' ' ' TYR . 4.5 mm? -67.02 -34.82 78.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.108 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.0 tp -56.13 -54.18 48.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.381 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.636 HD12 ' N ' ' A' ' 165' ' ' THR . 4.3 pp -64.29 -38.49 91.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.782 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.636 ' N ' HD12 ' A' ' 164' ' ' LEU . 84.9 m -55.63 -46.02 77.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.961 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.61 94.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 36.3 mt-30 -56.35 -46.42 79.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.572 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.55 -41.15 98.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.044 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 73.5 mtp -57.44 -47.94 80.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.519 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.44 -44.17 97.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.624 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' GLN . . . . . 0.895 ' HA ' ' HE3' ' A' ' 174' ' ' LYS . 85.7 mt-30 -59.07 -49.49 77.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -66.98 -41.09 87.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.784 0.326 . . . . 0.0 111.321 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.62 ' O ' HG13 ' A' ' 177' ' ' ILE . 58.2 m -62.42 -50.84 69.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.026 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.895 ' HE3' ' HA ' ' A' ' 171' ' ' GLN . 22.0 pttp -60.29 -40.09 89.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 175' ' ' THR . . . . . 0.509 ' O ' HG13 ' A' ' 179' ' ' ILE . 85.0 m -58.18 -47.55 83.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.045 0.45 . . . . 0.0 111.057 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.04 -34.9 77.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 173' ' ' SER . 21.7 mt -60.66 -49.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.713 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -59.94 -36.43 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 110.227 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 175' ' ' THR . 61.4 mt -61.96 -48.37 88.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.475 HD13 ' HB3' ' A' ' 134' ' ' GLN . 68.0 mt -61.93 -41.08 89.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -55.31 -43.86 75.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.444 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.7 ttm -60.91 -41.04 95.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.185 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -59.23 -40.67 86.61 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 131' ' ' LEU . 11.9 mt -58.23 -54.67 44.32 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.712 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 185' ' ' ARG . 47.9 mtp85 -54.75 -41.98 71.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.39 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.409 HH11 ' HG2' ' A' ' 186' ' ' ARG . 53.7 ttt-85 -62.8 -34.65 77.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.712 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.128 -179.909 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.445 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 99.8 mtt180 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.737 0.303 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.3 t -56.98 -51.87 63.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.375 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.25 -40.79 97.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.114 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.833 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.39 -43.97 98.65 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.522 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 184' ' ' LEU . 93.3 mt -67.5 -41.18 84.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.779 0.323 . . . . 0.0 111.197 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.2 mm-40 -63.73 -48.58 76.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.77 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.833 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.9 pttt -59.53 -41.53 90.23 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.014 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.67 -39.33 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.958 0.409 . . . . 0.0 110.686 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.589 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.6 tm? -58.95 -41.74 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.392 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.92 89.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.157 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.477 ' O ' HG23 ' A' ' 141' ' ' VAL . 68.7 mt -65.39 -48.04 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.194 -179.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 12.2 pt-20 -59.1 -45.4 90.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.375 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.98 -39.04 90.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.626 0.251 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -60.45 -44.29 95.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.209 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.0 t -66.26 -46.97 85.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.577 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.529 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 40.3 ttmt -61.63 -46.81 88.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.276 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 33.8 tp60 -62.69 -48.91 77.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.641 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.52 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.55 -34.62 86.63 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.753 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.87 -44.64 76.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.873 0.368 . . . . 0.0 110.348 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 51.7 mt-10 -60.15 -41.78 93.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.87 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ASN . . . . . 0.428 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 20.1 t-20 -59.04 -43.77 91.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.341 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.523 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.8 mmm -67.5 -45.37 76.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.6 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.599 HG13 ' O ' ' A' ' 145' ' ' ALA . 89.6 mt -52.88 -53.77 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.407 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 147' ' ' ASN . 22.3 pt20 -58.99 -36.55 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.033 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 54.9 m -54.93 -54.96 36.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.862 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.605 ' HB2' HD13 ' A' ' 163' ' ' LEU . 37.1 m-85 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.642 -179.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.036 0.446 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 98.8 mt -61.02 -36.39 79.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.004 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.605 HD13 ' HB2' ' A' ' 152' ' ' TYR . 39.9 tp -57.37 -46.42 83.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.104 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.54 -42.75 75.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.417 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.568 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.7 m -57.19 -42.74 81.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.819 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -71.0 -35.83 72.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.297 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 13.0 mm-40 -56.92 -48.82 77.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.991 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 165' ' ' THR . 19.4 pt20 -65.45 -41.37 93.49 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.162 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.8 mtm -59.51 -38.18 80.26 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-O 120.865 0.364 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.6 -45.43 94.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -59.8 -50.85 72.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.17 -39.55 93.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 43.1 t -56.86 -44.75 82.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.82 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 55.9 mtpt -61.06 -44.54 97.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.625 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -56.03 -41.69 75.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.88 -45.52 93.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.05 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.546 HG12 ' CD ' ' A' ' 138' ' ' GLU . 28.5 mt -57.85 -41.78 80.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.942 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.59 -49.31 73.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.754 0.311 . . . . 0.0 111.435 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 64.6 mt -62.12 -50.29 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.32 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -59.13 -43.97 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -53.55 -41.09 66.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.273 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.429 ' SD ' ' HD3' ' A' ' 185' ' ' ARG . 48.0 tpp -62.62 -38.24 89.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.306 179.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.69 -44.09 94.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.259 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -58.36 -55.27 37.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.429 ' HD3' ' SD ' ' A' ' 182' ' ' MET . 16.0 ptm180 -58.85 -38.63 79.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.727 0.299 . . . . 0.0 110.594 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -57.74 -40.45 79.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.739 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.867 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.488 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 6.5 tpm_? . . . . . 0 CA--C 1.529 0.152 0 CA-C-O 120.641 0.258 . . . . 0.0 111.511 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 89.6 t -63.53 -52.57 56.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.898 0.38 . . . . 0.0 111.54 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.77 85.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.505 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.552 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.41 -44.42 97.64 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.572 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 184' ' ' LEU . 94.8 mt -67.88 -41.0 83.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.851 0.358 . . . . 0.0 111.074 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 95.3 mt-10 -64.18 -49.19 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.537 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.463 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -57.2 -39.48 75.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.765 0.317 . . . . 0.0 110.608 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 95.0 mm-40 -58.29 -46.07 86.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.562 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 95.5 mt -54.62 -44.48 73.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.03 99.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.345 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.9 mt -59.74 -48.82 86.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.317 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.428 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.0 OUTLIER -55.67 -45.38 77.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.694 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 48.0 mt -62.35 -38.51 89.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -63.01 -42.81 99.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 0.0 110.479 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.69 -46.36 82.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.208 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.739 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 38.9 ttmt -61.01 -49.47 77.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -62.34 -43.55 98.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.449 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.68 -36.26 89.03 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.883 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.524 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.17 -41.77 80.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.96 0.409 . . . . 0.0 110.568 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.4 mt-10 -60.06 -44.57 94.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.999 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ASN . . . . . 0.544 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 19.3 t-20 -61.8 -44.86 96.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.554 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.5 mtp -61.0 -40.76 94.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 145' ' ' ALA . 85.3 mt -61.21 -51.07 77.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 147' ' ' ASN . 0.0 OUTLIER -66.85 -30.47 70.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.713 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.7 m -64.59 -50.61 66.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.86 179.807 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 161' ' ' LYS . . . . . 0.525 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 8.4 ptpp? . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.751 0.31 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.95 -35.92 72.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.819 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.501 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -57.03 -51.26 69.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.094 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 165' ' ' THR . 4.2 pp -65.03 -38.52 91.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.627 ' N ' HD12 ' A' ' 164' ' ' LEU . 89.7 m -55.63 -45.19 77.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.46 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -63.71 -40.68 97.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.325 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.6 mt-30 -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.934 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -60.69 -41.28 94.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.96 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.6 mtp -59.71 -47.48 85.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.477 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.546 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 60.7 tp -57.03 -44.47 82.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' GLN . . . . . 0.564 ' HA ' ' NZ ' ' A' ' 174' ' ' LYS . 65.8 tt0 -61.64 -43.14 99.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.081 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.41 -43.93 96.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.417 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.5 ' O ' HG13 ' A' ' 177' ' ' ILE . 89.3 p -62.29 -45.58 92.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.435 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.739 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 10.4 mtmp? -57.66 -49.64 75.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.6 m -55.73 -43.34 76.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.282 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.93 -41.01 97.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.072 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 173' ' ' SER . 64.1 mt -58.48 -41.07 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.025 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.6 -46.15 83.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.184 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 182' ' ' MET . 51.0 mm -62.93 -43.87 99.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.08 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.6 ' O ' HD23 ' A' ' 184' ' ' LEU . 72.9 mt -65.64 -40.73 88.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 110.501 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.507 ' HE ' ' NH2' ' A' ' 185' ' ' ARG . 78.4 ttt180 -52.06 -52.11 53.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.393 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 21.2 ptp -62.79 -39.77 95.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 86.4 mt-30 -55.27 -43.88 75.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.717 0.294 . . . . 0.0 110.483 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.4 mm? -61.53 -39.28 90.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.507 ' NH2' ' HE ' ' A' ' 181' ' ' ARG . 21.5 mmt85 -55.85 -58.16 9.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.417 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.439 HH11 ' HG2' ' A' ' 186' ' ' ARG . 0.6 OUTLIER -67.23 -32.78 74.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.406 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 111.044 -179.907 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 15.5 tpp85 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.717 0.294 . . . . 0.0 111.316 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.1 t -61.85 -54.85 29.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.363 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.83 -38.07 86.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.104 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.601 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.23 -45.27 96.38 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.524 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.58 ' HB3' HD21 ' A' ' 184' ' ' LEU . 93.3 mt -67.88 -43.9 78.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.709 0.29 . . . . 0.0 111.155 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 58.4 mm-40 -60.11 -48.27 82.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.672 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -60.19 -40.81 91.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.179 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.8 mm100 -56.68 -45.01 82.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.692 0.282 . . . . 0.0 110.923 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.9 tp -60.12 -42.73 95.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.893 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.74 96.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.8 mt -59.47 -42.3 87.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.8 mm-40 -58.59 -43.98 89.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.2 mt -60.11 -38.26 82.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.498 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 13.0 tmtt? -63.59 -52.85 59.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.228 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.1 -45.27 87.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.748 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.423 ' HE2' ' HD3' ' A' ' 174' ' ' LYS . 62.8 tttm -58.05 -45.77 86.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.056 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -64.06 -47.91 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.195 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.31 -32.16 79.8 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.822 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.644 ' O ' HG12 ' A' ' 149' ' ' ILE . . . -66.17 -43.99 85.32 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.105 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.6 mt-10 -58.96 -40.83 85.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.343 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -58.5 -42.63 88.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 83.5 mtp -66.4 -45.85 78.6 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.604 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 145' ' ' ALA . 43.0 mm -54.65 -42.91 63.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.688 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -72.62 -41.78 65.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.188 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 67.2 m -56.71 -52.86 63.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.86 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.942 -179.225 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.794 0.33 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.408 HD22 ' N ' ' A' ' 162' ' ' LEU . 3.8 mm? -70.07 -35.61 74.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.112 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.1 tp -54.66 -49.2 71.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.858 0.361 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.9 mt -67.04 -35.8 80.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.38 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.6 m -57.59 -47.85 81.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.257 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.56 -46.54 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.089 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 85.4 mt-30 -56.8 -36.99 70.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.154 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.2 tp60 -64.24 -44.24 92.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.821 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 165' ' ' THR . 39.1 mtm -63.2 -42.39 99.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.424 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 49.1 tp -61.22 -46.23 91.3 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -61.09 -44.5 97.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.287 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -57.74 -43.26 85.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.848 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.555 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.0 m -63.13 -43.32 98.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.061 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.4 mmmm -56.07 -51.91 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.516 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.3 m -56.41 -45.87 80.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.679 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 180' ' ' ILE . 34.4 mmtp -62.84 -41.81 99.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.487 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.657 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -59.99 -40.16 82.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.355 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.6 -46.06 90.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.681 ' O ' ' HG3' ' A' ' 182' ' ' MET . 67.0 mt -63.22 -44.15 99.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.928 0.394 . . . . 0.0 110.761 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.579 ' O ' HD23 ' A' ' 184' ' ' LEU . 69.7 mt -63.99 -38.2 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.897 0.38 . . . . 0.0 110.369 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 181' ' ' ARG . 40.3 ttt85 -54.93 -49.27 71.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.251 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 4.5 ppp? -65.54 -32.9 74.74 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.564 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 36.4 mt-30 -61.03 -47.25 87.28 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.851 0.357 . . . . 0.0 110.576 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.58 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -60.19 -43.92 95.5 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.669 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 185' ' ' ARG . 48.3 mtp85 -54.44 -44.19 72.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.601 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -63.79 -36.21 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.917 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.018 -179.923 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.419 ' HG2' HH11 ' A' ' 127' ' ' ARG . 55.1 ttp85 . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.779 0.323 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 72.6 t -47.51 -48.71 10.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.532 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.06 -37.23 81.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.583 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -60.2 -58.18 15.34 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.538 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 1.017 HD23 HD22 ' A' ' 184' ' ' LEU . 7.0 mp -53.25 -43.31 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.681 0.277 . . . . 0.0 111.71 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.3 mt-10 -64.36 -50.53 67.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 23.2 pttm -59.94 -37.92 80.92 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 46.5 mm-40 -59.22 -48.79 80.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.296 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 88.0 mt -57.64 -44.14 85.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.636 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -60.93 -49.7 76.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.056 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.83 -48.75 86.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.963 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.582 ' OE2' HD11 ' A' ' 180' ' ' ILE . 0.3 OUTLIER -59.33 -45.4 91.45 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.325 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 86.7 mt -58.66 -41.47 86.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 62.1 mttp -61.81 -49.71 75.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.378 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.36 -46.67 83.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 111.382 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.8 tttt -57.25 -47.35 81.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.051 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -59.07 -42.65 90.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.04 -37.65 94.9 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.188 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 170' ' ' LEU . . . -66.27 -41.17 90.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.1 0.476 . . . . 0.0 110.243 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -63.33 -39.35 94.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.44 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -58.32 -44.61 88.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.429 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 18.7 mmt -63.64 -48.33 77.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.142 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 145' ' ' ALA . 69.6 mt -55.19 -45.43 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 0.0 111.086 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.99 -39.7 90.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.091 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.5 m -65.37 -52.32 54.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.708 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 148' ' ' MET . 10.0 m-85 . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.608 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.2 tptt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.708 0.29 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.195 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.3 tp -55.66 -52.55 63.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.886 0.374 . . . . 0.0 110.464 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 87.3 mt -69.56 -37.14 76.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.491 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.45 ' O ' ' HG3' ' A' ' 169' ' ' MET . 94.6 m -55.52 -44.66 76.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.841 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.49 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.564 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -58.29 -38.11 76.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.149 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 94.5 mm-40 -63.62 -42.72 98.15 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.037 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.6 mtm -64.17 -40.43 96.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 49.3 tp -62.55 -42.88 99.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.984 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -58.79 -45.39 89.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.767 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -60.61 -41.46 94.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.727 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.7 m -62.05 -42.35 99.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.945 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.7 mtpp -57.91 -44.38 86.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.004 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 92.2 m -61.0 -46.11 92.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.0 mtpp -59.89 -47.87 84.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.853 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 180' ' ' ILE . 64.7 mt -60.23 -35.77 64.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.962 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 178' ' ' ASP . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 181' ' ' ARG . 30.4 t70 -57.72 -49.41 76.63 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.404 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 42.3 mm -60.65 -39.29 81.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.4 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.777 HD12 ' HA ' ' A' ' 177' ' ' ILE . 66.2 mt -56.39 -53.67 37.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.603 HH11 HG22 ' A' ' 177' ' ' ILE . 78.3 mtm-85 -52.38 -39.38 60.74 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.487 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 64.9 mtt -57.87 -40.2 79.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.434 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -70.37 -41.74 72.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.222 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 1.017 HD22 HD23 ' A' ' 131' ' ' LEU . 4.4 mm? -61.11 -51.71 67.94 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.504 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 16.9 ptm180 -59.29 -45.09 92.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -63.72 -35.75 81.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.098 0.475 . . . . 0.0 110.565 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.324 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.41 HH11 ' HG3' ' A' ' 127' ' ' ARG . 62.2 mtm-85 . . . . . 0 C--O 1.231 0.128 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.46 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 96.2 t -65.34 -48.82 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.294 . . . . 0.0 111.773 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.6 83.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.325 -179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.58 -46.03 95.12 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.535 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 184' ' ' LEU . 82.8 mt -65.61 -43.67 88.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.828 0.347 . . . . 0.0 111.093 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -60.64 -50.84 71.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.867 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 22.1 ptmt -57.93 -38.82 76.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.559 0.218 . . . . 0.0 110.907 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.0 mm-40 -57.92 -45.33 86.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.803 0.335 . . . . 0.0 110.66 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.519 ' HA ' ' CD ' ' A' ' 138' ' ' GLU . 60.5 tp -60.27 -38.34 83.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.271 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.6 80.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.07 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.8 mt -64.57 -49.09 82.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.677 ' OE1' HG13 ' A' ' 180' ' ' ILE . 7.6 pt-20 -57.89 -44.8 86.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.1 mt -59.89 -42.17 93.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.752 0.311 . . . . 0.0 110.943 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -59.39 -45.26 91.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.02 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.3 t -65.86 -45.94 90.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.667 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 40.2 ttmt -60.16 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.679 0.276 . . . . 0.0 111.107 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.31 -43.4 98.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.856 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.2 -37.86 94.68 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.335 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.37 -42.88 82.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 110.417 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.48 -41.22 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.736 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -58.07 -45.66 86.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.613 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 92.0 mmm -65.6 -46.04 80.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 145' ' ' ALA . 87.4 mt -55.79 -46.24 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.181 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 72.9 mt-30 -62.16 -41.2 98.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.0 m -64.79 -37.74 88.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.584 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.109 -179.311 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 161' ' ' LYS . . . . . 0.617 ' NZ ' ' HB2' ' A' ' 161' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.209 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.431 ' N ' ' HG3' ' A' ' 161' ' ' LYS . 60.7 tp -59.8 -43.41 94.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.494 0.188 . . . . 0.0 111.104 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 61.3 tp -59.11 -40.4 85.23 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.79 -42.71 72.11 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.065 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 93.2 m -57.42 -46.02 83.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.262 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.15 94.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.797 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 30.1 mm100 -57.27 -47.27 81.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.407 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.42 -38.33 89.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.021 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 69.0 mmm -59.92 -46.52 89.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.284 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.509 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -56.48 -46.97 80.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.539 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -62.88 -42.64 99.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.917 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 48.7 m -58.22 -43.94 87.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.113 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.672 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 7.5 mtpm? -59.2 -44.22 92.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.739 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 179' ' ' ILE . 87.9 m -57.49 -43.53 84.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.574 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 7.9 mtpm? -56.99 -49.68 75.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.722 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.589 HD12 ' NZ ' ' A' ' 142' ' ' LYS . 56.4 mt -57.9 -41.08 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.184 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.09 -45.96 89.52 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.889 0.376 . . . . 0.0 110.586 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 175' ' ' THR . 51.2 mm -58.53 -39.68 76.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.384 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.677 HG13 ' OE1' ' A' ' 138' ' ' GLU . 46.9 mm -60.68 -47.32 93.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.855 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.0 tpt85 -52.9 -42.13 65.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.186 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -60.93 -42.32 97.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.554 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -61.1 -46.11 91.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.614 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -57.84 -42.27 84.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.868 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 51.2 mtp85 -59.9 -46.37 89.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.879 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 47.6 mtp85 -60.93 -37.76 83.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.083 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.689 0.281 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 82.7 t -61.03 -57.15 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.6 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.73 90.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.562 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.837 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.16 -47.67 89.84 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.909 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.56 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 82.8 mt -67.51 -41.34 84.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.666 0.27 . . . . 0.0 111.535 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -61.76 -47.65 84.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.776 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.837 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.8 pttt -60.08 -42.35 94.43 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.81 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HB3' HD13 ' A' ' 180' ' ' ILE . 30.4 mm100 -61.04 -40.5 93.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.816 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.522 ' C ' HD13 ' A' ' 135' ' ' LEU . 3.4 tm? -58.62 -46.42 87.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.248 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ALA . . . . . 0.506 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -66.79 -45.95 76.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.07 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.559 ' O ' HG23 ' A' ' 141' ' ' VAL . 71.2 mt -60.96 -48.62 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.65 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.3 pt-20 -59.78 -43.82 94.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.585 HD23 HD13 ' A' ' 177' ' ' ILE . 84.0 mt -59.29 -45.16 92.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.684 0.278 . . . . 0.0 110.984 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.602 ' HB3' ' NZ ' ' A' ' 140' ' ' LYS . 8.1 mtpm? -59.73 -42.91 94.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.933 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.6 t -62.41 -40.55 88.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.734 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.3 tttt -61.35 -49.04 78.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.97 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -61.43 -44.39 97.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.536 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.17 -38.42 95.58 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.638 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.51 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.47 -41.51 84.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.976 0.417 . . . . 0.0 110.765 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 96.2 mt-10 -59.53 -44.14 93.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.021 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -60.85 -44.42 97.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.547 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.536 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 91.9 mmm -64.3 -42.7 96.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.238 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.561 HD11 ' HA ' ' A' ' 167' ' ' GLN . 88.8 mt -62.63 -47.78 91.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 84.6 mt-30 -63.52 -44.94 92.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.182 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 94.5 m -62.5 -49.43 75.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.68 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.691 -179.57 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 161' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 22.0 pttp . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.77 0.319 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.416 ' N ' ' HG3' ' A' ' 161' ' ' LYS . 90.7 mt -64.53 -37.68 88.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.368 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 62.8 tp -58.51 -42.66 88.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.43 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.498 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 85.1 mt -63.05 -38.73 92.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.402 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.0 m -65.43 -41.74 93.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.888 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.91 -48.63 70.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.597 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.561 ' HA ' HD11 ' A' ' 149' ' ' ILE . 3.2 pt20 -58.24 -38.57 77.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.077 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -63.09 -39.98 96.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.827 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 68.5 mtp -61.58 -46.33 90.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.813 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.513 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 56.2 tp -57.02 -46.1 82.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.286 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -60.87 -46.8 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.22 -42.42 98.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.6 m -62.86 -49.74 73.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.429 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.9 mtpp -57.14 -43.24 82.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.011 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.1 m -59.01 -47.42 85.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.94 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.3 -40.21 81.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.585 HD13 HD23 ' A' ' 139' ' ' LEU . 53.0 mt -59.74 -39.78 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -62.47 -53.13 59.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.279 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -62.48 -56.15 19.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.084 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.65 HD12 ' OE1' ' A' ' 138' ' ' GLU . 68.0 mt -52.7 -40.24 33.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.627 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.587 ' HD3' HD12 ' A' ' 184' ' ' LEU . 15.6 tpp85 -54.77 -43.95 73.23 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.984 0.421 . . . . 0.0 110.081 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 91.2 mmm -57.32 -43.7 83.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.458 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -67.32 -32.27 73.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.276 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.587 HD12 ' HD3' ' A' ' 181' ' ' ARG . 20.7 mt -57.09 -57.13 13.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.252 0.549 . . . . 0.0 110.663 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -62.6 -41.57 99.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.549 ' HD2' ' O ' ' A' ' 186' ' ' ARG . 4.7 tmm_? -59.22 -40.27 85.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.565 -179.705 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.576 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 5.5 tpm_? . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.745 0.307 . . . . 0.0 111.475 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.2 t -65.49 -51.51 62.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.51 93.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.921 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.79 -49.67 66.7 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.827 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 184' ' ' LEU . 98.1 mt -65.74 -44.85 84.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.831 0.348 . . . . 0.0 111.083 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -56.81 -50.8 71.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.627 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 15.0 ptmm? -58.71 -36.63 74.56 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.414 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.715 ' HB3' HD13 ' A' ' 180' ' ' ILE . 48.1 mm-40 -56.2 -45.22 79.9 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.509 179.131 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 4.5 mm? -58.74 -41.18 85.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.065 0.46 . . . . 0.0 110.485 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.1 89.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.935 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.7 mt -66.46 -49.53 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.127 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.494 ' OE2' ' HG ' ' A' ' 139' ' ' LEU . 1.4 pp20? -60.19 -43.32 96.0 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.464 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.494 ' HG ' ' OE2' ' A' ' 138' ' ' GLU . 93.1 mt -56.54 -45.31 81.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.82 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -62.39 -47.06 85.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 137' ' ' ILE . 61.5 t -64.93 -40.83 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.424 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.488 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 61.8 tttm -62.21 -50.21 72.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.173 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -64.01 -44.89 91.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.763 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.455 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -63.15 -34.78 90.89 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.534 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.07 -42.48 80.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.952 0.406 . . . . 0.0 110.799 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.4 mt-10 -60.7 -43.59 97.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -60.99 -41.36 96.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.455 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.2 mtp -64.66 -44.3 90.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 79.9 mt -58.64 -50.29 79.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.544 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -65.48 -39.97 92.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.502 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.8 m -57.4 -49.33 76.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.779 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.97 ' HB2' HD13 ' A' ' 163' ' ' LEU . 4.2 m-85 . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.708 0.29 . . . . 0.0 111.355 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.729 0.3 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.456 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 98.2 mt -62.91 -38.3 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.255 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.97 HD13 ' HB2' ' A' ' 152' ' ' TYR . 54.5 tp -58.12 -43.4 87.18 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.51 -42.49 92.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.529 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.7 m -59.06 -43.04 91.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.944 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.01 -44.16 97.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -57.74 -43.23 85.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.398 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -60.51 -38.02 83.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.048 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.6 mtp -62.11 -47.22 85.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.848 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.515 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -57.8 -48.55 79.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.006 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -62.43 -43.53 98.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.013 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' ASP . . . . . 0.558 ' OD1' ' HE2' ' A' ' 176' ' ' LYS . 8.7 t70 -61.29 -43.58 98.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.092 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 177' ' ' ILE . 38.8 t -59.72 -46.17 89.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -57.93 -40.31 80.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.901 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 88.7 m -58.62 -45.93 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.558 ' HE2' ' OD1' ' A' ' 172' ' ' ASP . 68.0 mttm -61.07 -43.81 98.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 173' ' ' SER . 63.0 mt -55.61 -40.87 61.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.355 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -64.97 -48.62 73.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.073 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 43.4 mm -61.73 -47.19 94.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.715 HD13 ' HB3' ' A' ' 134' ' ' GLN . 74.8 mt -61.82 -40.58 87.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.001 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 181' ' ' ARG . 41.5 ttt85 -55.18 -44.75 75.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 43.9 tpp -61.23 -39.98 92.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.154 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -59.66 -41.01 89.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.709 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.491 HD23 HD13 ' A' ' 131' ' ' LEU . 8.2 mt -59.31 -43.99 92.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.226 0.536 . . . . 0.0 109.954 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.621 ' HA ' HH11 ' A' ' 185' ' ' ARG . 3.3 mmm180 -56.6 -41.87 77.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.218 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.95 -39.39 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.716 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.018 -179.926 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.551 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 4.0 mmp_? . . . . . 0 N--CA 1.461 0.107 0 CA-C-O 120.707 0.289 . . . . 0.0 111.537 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 59.8 t -58.64 -46.21 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.61 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.72 92.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.702 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.746 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -65.62 -44.98 91.68 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.117 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 184' ' ' LEU . 92.4 mt -65.61 -43.22 90.3 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.744 -0.268 . . . . 0.0 111.474 -179.378 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.8 mm-40 -64.39 -46.61 82.58 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.746 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 66.0 pttt -57.83 -41.12 81.65 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.771 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 13.2 mm100 -59.46 -43.27 93.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.692 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.3 tm? -60.43 -43.82 96.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.88 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.3 84.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.485 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.1 -40.93 76.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.615 ' HB3' HD11 ' A' ' 177' ' ' ILE . 63.2 mm-40 -61.67 -42.1 98.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.0 mt -59.16 -42.83 91.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.292 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.07 -47.75 83.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.732 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.7 t -71.28 -48.77 52.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -60.88 -52.21 66.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.5 -179.072 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.21 -46.44 88.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.832 0.349 . . . . 0.0 110.752 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.518 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -62.34 -34.84 90.52 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.149 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.89 -40.3 91.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.937 0.399 . . . . 0.0 110.211 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -59.84 -42.08 92.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.32 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -59.99 -42.12 93.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.201 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 89.1 mmm -64.46 -42.66 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.63 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.3 mt -60.69 -50.46 80.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.472 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -66.13 -42.52 89.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.761 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -49.53 77.21 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.919 ' HB2' HD13 ' A' ' 163' ' ' LEU . 2.2 m-85 . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.717 0.294 . . . . 0.0 111.706 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.776 0.322 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.562 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 97.2 mt -58.4 -39.02 78.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.437 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.919 HD13 ' HB2' ' A' ' 152' ' ' TYR . 30.8 tp -57.78 -46.86 83.98 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.068 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 93.2 mt -58.77 -41.72 87.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.938 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 86.8 m -61.12 -41.32 96.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.519 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.29 80.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.445 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -60.41 -45.47 93.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.133 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.5 -40.78 97.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.538 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.6 mmm -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.585 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 2.9 tm? -61.48 -44.32 97.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.3 -47.17 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.288 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 63.6 t0 -66.38 -40.95 90.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.191 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.5 m -62.12 -52.41 63.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.914 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.597 ' NZ ' ' HB2' ' A' ' 174' ' ' LYS . 0.0 OUTLIER -61.83 -41.65 98.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.506 -179.466 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 93.4 m -57.84 -48.53 79.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.795 0.331 . . . . 0.0 111.255 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.559 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 4.0 mmmp? -58.98 -40.25 84.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.615 HD11 ' HB3' ' A' ' 138' ' ' GLU . 40.0 mt -59.91 -38.63 77.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 178' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 181' ' ' ARG . 58.2 m-20 -60.86 -45.04 96.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 110.009 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 56.9 mt -59.59 -49.05 85.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.361 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.525 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -62.18 -36.42 74.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.606 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 185' ' ' ARG . 51.2 ttt-85 -52.39 -50.29 62.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.543 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 62.0 mtm -63.54 -38.75 92.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.871 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 80.9 mt-30 -56.72 -46.42 81.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.747 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -61.92 -42.12 98.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.002 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' A' ' 185' ' ' ARG . 3.7 mmp_? -52.42 -48.27 65.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.21 -35.32 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.459 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.789 0.328 . . . . 0.0 111.171 -179.74 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 127' ' ' ARG . 54.2 ttp85 . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.858 0.361 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.25 -48.25 85.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.579 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -61.5 -45.64 93.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.701 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.588 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -57.98 -48.73 80.69 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.989 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 184' ' ' LEU . 64.4 mt -68.34 -43.43 77.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.015 0.436 . . . . 0.0 111.05 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.75 -46.53 89.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 16.9 ptpt -61.71 -40.37 94.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.978 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -56.21 -45.83 79.72 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.8 0.333 . . . . 0.0 110.761 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 97.2 mt -58.91 -45.93 89.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.315 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.4 -47.76 80.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 133' ' ' LYS . 76.4 mt -56.56 -43.34 78.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.437 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.0 mm-40 -61.87 -41.79 98.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.158 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.2 mt -57.91 -39.95 79.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.859 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -62.69 -48.99 76.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.035 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 51.1 t -65.5 -42.49 93.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -59.69 -46.41 89.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.669 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -61.72 -47.23 86.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.417 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.97 -36.41 90.16 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.606 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.632 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -66.57 -41.52 88.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 110.501 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.675 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.654 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.483 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.0 mtp -70.57 -48.93 52.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.222 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.2 mt -53.83 -47.29 63.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.361 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -66.69 -38.17 86.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.316 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 55.6 m -61.56 -51.37 68.84 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.654 ' HB2' HD13 ' A' ' 163' ' ' LEU . 18.4 m-85 . . . . . 0 C--N 1.33 -0.264 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? . . . . . 0 C--O 1.233 0.186 0 CA-C-O 121.01 0.433 . . . . 0.0 110.11 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.11 -31.56 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.365 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.654 HD13 ' HB2' ' A' ' 152' ' ' TYR . 51.2 tp -57.91 -48.78 78.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.635 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.92 -44.84 91.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.821 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.1 m -60.96 -41.21 95.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.01 95.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.902 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.46 ' HA ' HD11 ' A' ' 149' ' ' ILE . 36.3 mt-30 -59.45 -40.04 85.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.101 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -61.03 -39.39 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.357 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 67.2 mtp -66.16 -45.63 80.25 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.086 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 145' ' ' ALA . 2.9 tm? -57.38 -52.18 66.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.256 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -64.18 -40.94 97.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.375 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -61.79 -44.13 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.898 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 177' ' ' ILE . 47.6 t -59.11 -45.57 90.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.046 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.69 -41.98 87.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.907 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.0 m -56.24 -47.13 79.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.969 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.524 ' O ' HG13 ' A' ' 180' ' ' ILE . 63.7 mttp -61.43 -39.8 92.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.576 ' O ' ' HG2' ' A' ' 181' ' ' ARG . 57.7 mt -62.72 -41.58 92.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.415 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -60.57 -51.44 69.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.368 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.445 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 34.1 pt -63.07 -40.02 87.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.512 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.56 HD13 ' HB3' ' A' ' 134' ' ' GLN . 62.4 mt -60.22 -45.34 96.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.59 0.233 . . . . 0.0 110.824 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 26.1 mmm180 -56.2 -44.13 79.17 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.324 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.762 ' HG3' HH21 ' A' ' 185' ' ' ARG . 45.8 ttm -59.36 -40.23 85.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.412 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 99.3 mm-40 -60.75 -38.28 84.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.269 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.749 HD22 HD13 ' A' ' 131' ' ' LEU . 8.3 mt -60.34 -43.67 96.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.227 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.762 HH21 ' HG3' ' A' ' 182' ' ' MET . 72.6 mtm180 -56.8 -46.3 81.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.176 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -65.29 -38.87 91.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.949 179.804 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.506 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 29.7 tpt180 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.86 0.362 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.437 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 92.1 t -57.46 -53.3 45.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.347 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.83 -36.74 84.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -59.89 -43.8 97.71 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.341 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.535 ' HB3' HD11 ' A' ' 184' ' ' LEU . 77.5 mt -67.1 -41.6 86.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.89 0.376 . . . . 0.0 110.807 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -63.18 -49.63 73.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.591 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.441 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.36 -41.49 89.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.585 0.231 . . . . 0.0 110.922 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.1 mm-40 -58.61 -41.32 85.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 135' ' ' LEU . 1.7 tm? -59.95 -43.97 94.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.641 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.84 71.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.968 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 133' ' ' LYS . 70.9 mt -58.5 -46.54 89.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.542 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' HB3' ' A' ' 176' ' ' LYS . 96.0 mt-10 -59.62 -45.32 92.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.79 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 70.6 mt -62.16 -33.57 74.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.341 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -58.67 -48.46 81.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.702 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.4 t -71.4 -42.21 73.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.17 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.665 ' HZ3' ' HD3' ' A' ' 174' ' ' LYS . 39.5 ttmt -58.67 -50.15 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -62.34 -42.98 99.83 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.649 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.24 -38.01 93.87 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.104 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.21 -40.94 86.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.97 0.414 . . . . 0.0 110.375 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.9 mt-10 -59.09 -44.6 91.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.268 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -60.96 -39.84 91.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.798 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.0 mtp -64.57 -37.21 86.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.693 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 72.4 mt -64.62 -45.84 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.817 0.342 . . . . 0.0 111.042 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.61 -42.28 74.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.352 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 88.8 m -68.13 -48.54 65.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.656 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.448 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 1.3 m-85 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.67 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.731 0.3 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.448 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 91.8 mt -61.35 -39.89 92.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.556 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 152' ' ' TYR . 65.5 tp -58.66 -45.59 89.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.649 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.45 -40.65 87.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.57 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -57.57 -42.95 84.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.753 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -60.43 -41.96 95.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -57.54 -43.06 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.319 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.34 -40.57 91.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.126 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.523 ' HA ' ' OD2' ' A' ' 172' ' ' ASP . 0.0 OUTLIER -60.74 -36.61 79.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.847 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.8 tm? -69.2 -45.81 68.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.707 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -64.76 -45.96 84.15 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 169' ' ' MET . 3.0 p30 -64.42 -37.73 88.55 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.07 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.407 ' HB2' ' HB2' ' A' ' 142' ' ' LYS . 90.3 p -62.76 -44.04 97.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.665 ' HD3' ' HZ3' ' A' ' 142' ' ' LYS . 74.9 mmtt -54.84 -48.15 73.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.307 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.1 m -56.06 -43.44 77.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.959 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.465 ' HB3' ' CD ' ' A' ' 138' ' ' GLU . 63.3 mttp -53.37 -46.89 69.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.052 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.521 HD13 ' HZ1' ' A' ' 142' ' ' LYS . 1.8 mp -58.16 -41.74 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.691 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 178' ' ' ASP . . . . . 0.415 ' HA ' ' HD2' ' A' ' 181' ' ' ARG . 1.2 m-20 -55.76 -44.37 77.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.194 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 1.7 mp -59.36 -46.34 92.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.163 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.683 ' O ' HD13 ' A' ' 184' ' ' LEU . 44.6 mt -57.81 -41.11 79.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.728 0.299 . . . . 0.0 110.889 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 98.4 mtt180 -55.04 -50.32 69.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.225 0.536 . . . . 0.0 110.82 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 25.1 ttm -67.49 -42.99 82.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.093 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 49.1 mm-40 -62.16 -47.8 82.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.82 0.343 . . . . 0.0 111.474 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 180' ' ' ILE . 6.5 mp -61.69 -47.86 83.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.51 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 44.8 mmm-85 -60.25 -46.4 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.72 0.295 . . . . 0.0 110.963 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.01 -39.83 91.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.038 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.075 -179.776 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.766 0.317 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.501 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 57.3 t -61.84 -44.4 98.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.82 89.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.24 -43.13 98.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.518 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 184' ' ' LEU . 92.3 mt -67.52 -40.27 85.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.723 0.297 . . . . 0.0 111.196 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -64.44 -49.14 72.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.586 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.581 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -58.11 -41.38 83.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.876 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.03 -42.12 97.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.88 0.372 . . . . 0.0 110.76 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.503 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 67.0 tp -59.64 -45.51 91.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.102 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.68 -40.88 98.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.55 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.648 HG23 ' NZ ' ' A' ' 140' ' ' LYS . 81.8 mt -61.33 -50.14 81.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.876 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.652 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.8 pt-20 -65.86 -39.97 91.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.278 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.8 mt -58.87 -44.91 91.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 112.046 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.648 ' NZ ' HG23 ' A' ' 137' ' ' ILE . 23.5 pttm -65.68 -42.95 90.65 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.868 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.5 t -64.07 -43.51 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.967 0.413 . . . . 0.0 110.627 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.451 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttm -63.08 -43.27 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.626 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.65 -43.02 98.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.834 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.452 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.32 -38.95 96.54 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.698 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.452 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -69.01 -42.18 76.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.011 0.434 . . . . 0.0 110.95 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 55.5 mt-10 -61.72 -44.72 96.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.071 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -60.25 -44.18 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.086 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.8 mmm -64.06 -48.78 74.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.348 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.612 HD11 ' HA ' ' A' ' 167' ' ' GLN . 77.6 mt -59.69 -46.46 93.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.422 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -65.67 -41.14 92.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.443 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.6 m -58.31 -45.66 87.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.859 0.361 . . . . 0.0 110.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.718 179.662 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.705 0.288 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.78 -32.42 72.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.951 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 45.5 tp -54.86 -50.6 68.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.843 0.354 . . . . 0.0 110.236 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 168' ' ' GLN . 81.3 mt -64.35 -37.98 89.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.874 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 96.9 m -56.58 -48.43 77.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.106 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.26 88.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.874 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.612 ' HA ' HD11 ' A' ' 149' ' ' ILE . 88.2 mt-30 -56.79 -42.76 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.446 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 164' ' ' LEU . 89.0 mt-30 -61.34 -41.59 97.29 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.228 179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.63 -47.34 84.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.494 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 57.0 tp -58.63 -40.67 83.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.887 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -57.82 -48.0 81.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.903 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.47 -42.92 97.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.412 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 49.8 m -59.04 -45.91 89.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -54.67 -42.05 70.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.493 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -58.76 -40.97 85.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.515 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.414 ' O ' HG13 ' A' ' 180' ' ' ILE . 54.5 mtpt -58.62 -46.69 86.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.221 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 2.0 mp -58.82 -42.49 85.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.311 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 178' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.4 m-20 -57.56 -54.89 41.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.737 0.303 . . . . 0.0 111.754 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.429 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.38 -46.55 96.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.602 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.652 HD12 ' OE1' ' A' ' 138' ' ' GLU . 53.9 mt -57.65 -44.46 85.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.023 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.525 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 78.1 mtp180 -56.16 -39.35 72.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.2 mmt -59.13 -41.19 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.597 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -67.72 -44.68 77.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -61.21 -49.64 76.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.633 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 3.5 ptm85 -59.51 -44.42 93.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.137 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 182' ' ' MET . 21.2 mmt85 -62.83 -38.56 91.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.961 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.593 -179.701 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 79.4 ttt180 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.863 0.363 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 79.2 t -58.94 -51.29 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.59 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.77 -39.44 93.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.294 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.605 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -59.2 -44.69 96.24 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.58 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 87.6 mt -65.39 -44.33 87.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.853 0.358 . . . . 0.0 111.143 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.73 -46.39 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.734 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 24.2 pttm -58.98 -38.48 79.23 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.662 0.268 . . . . 0.0 110.778 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 47.5 mm-40 -59.71 -46.49 88.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.787 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 62.2 tp -56.98 -44.85 83.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.568 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.86 -51.06 71.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.773 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.518 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.8 mt -60.97 -46.3 96.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.189 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.647 ' HB3' HG12 ' A' ' 177' ' ' ILE . 0.2 OUTLIER -57.39 -46.27 83.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.951 -179.779 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 94.2 mt -58.1 -42.66 86.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.662 0.268 . . . . 0.0 111.053 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.482 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 7.4 tmtm? -62.13 -45.88 91.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.492 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 137' ' ' ILE . 47.8 t -62.49 -44.49 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.205 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.89 -45.23 93.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.942 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -62.04 -39.54 92.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.695 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.3 -40.99 96.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.51 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.15 -42.77 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.981 0.419 . . . . 0.0 110.412 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 51.0 mt-10 -61.96 -40.4 95.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.673 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -58.68 -44.83 90.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.546 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.432 ' HB2' ' HE3' ' A' ' 148' ' ' MET . 69.5 mtm -66.35 -41.09 90.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.151 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.4 mt -62.8 -49.5 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.799 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 15.6 pt20 -64.13 -40.74 96.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.663 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.2 m -65.68 -42.91 90.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.472 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.1 -179.245 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 tptm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.9 tp -67.91 -33.48 74.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 69.1 tp -56.15 -47.46 78.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.423 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.0 -42.52 94.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.568 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -59.24 -41.57 89.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.954 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.17 97.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 85.6 mt-30 -58.79 -41.71 87.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.895 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -60.35 -40.27 90.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.036 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.8 mtp -61.82 -48.54 80.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.787 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.525 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -57.97 -45.79 86.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.811 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 171' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 30.9 mm100 -60.94 -41.0 95.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.164 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.56 -44.57 86.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.115 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.541 ' HA ' ' HG2' ' A' ' 176' ' ' LYS . 52.8 m -66.65 -47.2 73.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.858 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.639 ' HD3' ' N ' ' A' ' 175' ' ' THR . 0.0 OUTLIER -60.25 -35.64 75.95 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.826 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 175' ' ' THR . . . . . 0.639 ' N ' ' HD3' ' A' ' 174' ' ' LYS . 85.7 m -71.47 -45.55 62.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 173' ' ' SER . 19.3 ptpt -63.81 -38.49 91.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.803 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.647 HG12 ' HB3' ' A' ' 138' ' ' GLU . 85.3 mt -63.37 -43.99 98.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.951 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -57.15 -44.04 83.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.966 0.413 . . . . 0.0 110.212 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 175' ' ' THR . 47.6 mm -61.2 -43.79 97.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.497 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 72.2 mt -58.82 -48.9 84.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -51.03 -41.65 59.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.252 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 48.4 tpp -60.71 -38.76 86.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.221 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -64.02 -43.72 94.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.967 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.2 mm? -60.64 -54.57 43.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.497 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.08 -41.05 91.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.682 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.24 -36.28 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.214 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.389 -179.525 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.43 HH11 ' HG3' ' A' ' 127' ' ' ARG . 46.2 ttm-85 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.77 0.319 . . . . 0.0 111.446 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 1.4 p -60.75 -44.55 97.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.255 0.55 . . . . 0.0 110.9 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.455 ' N ' ' CG1' ' A' ' 128' ' ' VAL . . . -58.44 -44.21 89.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.457 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.467 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.29 -44.2 98.01 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.785 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.56 HD13 ' HG ' ' A' ' 184' ' ' LEU . 92.6 mt -66.88 -42.42 85.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.28 . . . . 0.0 111.412 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 51.0 mt-10 -64.07 -47.92 78.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.865 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.07 -42.64 90.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.645 0.26 . . . . 0.0 111.154 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.562 ' HB3' HD13 ' A' ' 180' ' ' ILE . 50.8 mm-40 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.92 0.391 . . . . 0.0 110.697 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 135' ' ' LEU . 2.8 tm? -58.76 -40.31 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.426 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' ' 140' ' ' LYS . . . -66.91 -43.34 83.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.385 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 133' ' ' LYS . 64.8 mt -59.99 -49.66 83.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.06 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 11.0 pt-20 -58.12 -43.28 87.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.065 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.3 mt -60.1 -42.24 94.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.665 0.269 . . . . 0.0 111.33 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 136' ' ' ALA . 14.6 mmmm -60.11 -47.31 86.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.711 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 48.4 t -64.56 -42.14 94.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.276 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.03 -50.96 71.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.269 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -64.61 -49.18 72.1 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.246 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -55.51 -36.27 63.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.974 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.2 -40.74 94.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 110.131 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.0 mt-10 -62.07 -44.51 96.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.552 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -60.2 -40.11 88.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.742 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.3 mtp -65.3 -44.58 87.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.2 mt -61.94 -44.2 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.354 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 97.4 mm-40 -67.09 -45.48 77.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.443 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -61.92 -50.34 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.644 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.644 -179.636 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 61.2 mttp . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.797 0.332 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.96 -38.13 87.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.1 tp -56.94 -47.71 80.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.06 -41.2 99.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.0 m -60.18 -47.04 87.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.62 75.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.216 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -57.34 -37.23 72.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.984 0.421 . . . . 0.0 109.91 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -60.46 -40.91 92.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.042 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 165' ' ' THR . 40.9 mtm -61.78 -40.68 96.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.195 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 59.8 tp -61.36 -42.17 98.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.969 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' GLN . . . . . 0.782 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 41.2 tt0 -57.86 -49.58 76.2 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.901 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 172' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 33.3 m-20 -63.0 -40.85 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.769 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 177' ' ' ILE . 45.7 t -57.88 -44.77 86.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.782 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 53.8 mtmt -58.3 -51.62 69.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.936 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.8 m -55.63 -41.8 74.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.955 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 172' ' ' ASP . 75.7 mmtt -60.88 -43.65 98.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.764 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.516 HG12 ' CD ' ' A' ' 138' ' ' GLU . 49.3 mt -60.93 -44.92 98.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.698 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.93 -47.37 80.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 111.587 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 69.9 mt -64.99 -50.66 73.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.515 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.562 HD13 ' HB3' ' A' ' 134' ' ' GLN . 44.7 mt -59.28 -58.92 4.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.86 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -51.01 -39.03 54.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.051 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.8 ttm -61.15 -39.41 89.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.89 0.376 . . . . 0.0 110.162 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 11.9 mm100 -62.01 -43.37 98.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.876 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.56 ' HG ' HD13 ' A' ' 131' ' ' LEU . 9.5 mp -58.87 -45.97 88.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.859 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.427 ' HG2' HH11 ' A' ' 185' ' ' ARG . 47.5 mtp85 -56.0 -44.35 78.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 186' ' ' ARG . 12.1 tpt180 -60.9 -33.7 73.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.646 -179.528 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 39.8 ttm180 . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.79 0.329 . . . . 0.0 111.052 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 74.5 t -60.09 -50.67 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.602 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.9 95.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.55 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.84 -41.25 99.13 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.375 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.594 ' HB3' HD21 ' A' ' 184' ' ' LEU . 97.2 mt -67.79 -44.39 77.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.789 0.328 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 65.7 mm-40 -62.82 -47.61 82.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.713 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.65 -42.65 97.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.436 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -59.0 -52.05 67.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.674 0.273 . . . . 0.0 111.159 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.56 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 52.7 tp -52.15 -43.08 63.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.123 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.99 86.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.218 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.9 mt -60.05 -51.37 73.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.585 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.464 ' HG3' ' HE3' ' A' ' 176' ' ' LYS . 5.1 mp0 -60.57 -37.45 81.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.4 mt -59.67 -44.95 93.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.782 0.325 . . . . 0.0 111.06 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -67.91 -46.83 70.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.391 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.0 t -63.01 -46.66 95.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.481 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.496 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 64.0 tttm -62.68 -45.81 91.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.801 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -60.66 -45.88 92.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.64 -39.98 97.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.564 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.44 -42.2 92.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 110.308 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.5 mt-10 -63.58 -40.63 97.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.677 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -56.67 -45.04 81.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.232 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.93 -42.02 81.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 145' ' ' ALA . 88.8 mt -58.39 -44.28 88.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.302 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.2 mt-30 -64.36 -46.35 83.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.456 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 52.1 m -62.82 -50.66 70.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.062 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.615 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.8 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.76 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 mttp . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.738 0.304 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.577 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.7 mt -60.31 -36.84 78.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.796 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' HB2' ' A' ' 152' ' ' TYR . 47.9 tp -56.09 -44.81 79.37 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.93 -43.65 98.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.454 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 91.0 m -62.09 -41.38 98.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -59.09 -42.56 90.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.008 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -59.34 -44.93 92.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.055 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -62.08 -37.54 85.43 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.959 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 169' ' ' MET . 0.0 OUTLIER -58.07 -44.45 87.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.83 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.496 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 51.1 tp -65.37 -40.57 93.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.158 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -59.29 -46.29 88.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.442 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -65.03 -46.05 82.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.551 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.524 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -59.79 -47.4 85.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.605 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -58.52 -42.54 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.598 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.2 m -58.81 -50.6 73.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.744 0.307 . . . . 0.0 111.293 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.464 ' HE3' ' HG3' ' A' ' 138' ' ' GLU . 52.5 mtmt -57.7 -40.84 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.028 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 173' ' ' SER . 73.1 mt -61.58 -38.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.321 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.65 -50.55 72.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.389 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.447 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -64.87 -50.14 76.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.332 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 66.1 mt -59.14 -43.22 88.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.868 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.1 tpt180 -54.83 -43.11 72.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.596 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.0 -44.95 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.606 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.97 -36.18 80.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.94 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.6 mm? -69.25 -41.98 76.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.425 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 79.3 mtp180 -58.09 -51.8 68.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 186' ' ' ARG . 3.7 ptp180 -63.35 -36.31 83.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.159 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.872 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.526 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 21.3 tpp180 . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.687 0.28 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.59 -49.45 84.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.586 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.45 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.409 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.506 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.66 -42.33 99.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.394 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.6 ' HB3' HD22 ' A' ' 184' ' ' LEU . 83.2 mt -66.5 -44.19 83.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 0.0 110.954 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -64.26 -47.1 80.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.967 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.628 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -57.53 -42.12 82.24 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.596 0.236 . . . . 0.0 110.944 -179.482 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.531 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 48.6 mm-40 -59.15 -43.68 92.08 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.798 0.332 . . . . 0.0 110.518 179.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 89.9 mt -60.04 -40.93 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.005 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.54 -47.37 86.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.164 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -58.78 -38.93 75.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.811 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.637 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.9 mm-40 -59.44 -46.58 88.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.235 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.4 mt -59.76 -39.81 86.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.274 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -61.46 -47.77 84.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.138 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.4 -47.1 68.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.509 ' HE3' ' HD3' ' A' ' 174' ' ' LYS . 87.2 tttt -58.45 -49.51 77.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.191 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -59.71 -43.68 94.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.562 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.09 -41.38 94.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.367 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.463 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.36 -40.97 94.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.056 0.455 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 56.6 mt-10 -62.75 -40.02 95.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.469 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -58.03 -45.44 86.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.756 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 44.3 mtm -64.78 -47.23 78.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.938 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.5 mt -55.21 -45.58 77.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.03 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.4 mt-30 -64.54 -40.8 96.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.781 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.1 m -60.33 -45.57 92.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.242 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.412 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.0 m-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.936 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 161' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.675 0.274 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.4 mp -70.57 -31.66 68.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.589 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.59 -52.02 66.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.837 0.351 . . . . 0.0 110.417 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.73 -39.38 93.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.014 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 169' ' ' MET . 92.7 m -58.48 -39.94 81.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.669 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.59 94.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.777 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -56.89 -44.47 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.293 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.3 tp60 -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.291 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 165' ' ' THR . 77.9 mmm -63.03 -49.96 72.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.138 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.494 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -58.03 -46.6 85.05 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.609 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -64.94 -40.87 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.179 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.2 -47.63 85.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.31 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -60.27 -44.32 95.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.154 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.583 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.93 -42.16 84.28 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.202 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.2 m -60.45 -47.26 86.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.143 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -62.21 -43.16 99.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.932 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.637 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.9 mt -60.83 -44.14 97.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -56.41 -43.39 79.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.912 0.387 . . . . 0.0 110.334 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.497 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 68.2 mt -61.73 -44.8 99.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.819 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.43 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 70.2 mt -61.08 -45.81 97.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.436 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' A' ' 184' ' ' LEU . 29.2 tpt180 -53.71 -46.98 70.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.77 0.319 . . . . 0.0 110.813 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.6 mmt -59.24 -38.94 81.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.288 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 84.7 mt-30 -64.85 -36.34 84.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.028 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 131' ' ' LEU . 9.4 mt -60.19 -50.87 71.97 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.185 0.517 . . . . 0.0 110.818 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.64 -45.82 92.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.14 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -66.44 -33.85 76.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.208 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.765 -179.585 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.827 0.346 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -63.14 -40.04 87.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.974 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.39 98.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.807 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -64.34 -46.94 89.25 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.702 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.471 ' HB3' HD22 ' A' ' 184' ' ' LEU . 79.6 mt -66.86 -41.13 87.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.997 0.427 . . . . 0.0 111.06 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -62.55 -48.35 79.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.807 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.5 pttt -60.62 -40.5 92.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.546 0.212 . . . . 0.0 111.118 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 30.8 mm100 -58.55 -44.56 89.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.893 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.579 HD21 HD11 ' A' ' 184' ' ' LEU . 95.6 mt -60.21 -42.2 94.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.09 -45.3 95.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.08 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.508 ' O ' HG23 ' A' ' 141' ' ' VAL . 67.5 mt -62.26 -42.85 96.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.101 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.684 ' HB3' HD11 ' A' ' 177' ' ' ILE . 59.3 mm-40 -59.29 -45.96 89.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.327 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.6 mt -58.72 -41.55 86.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.009 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -64.99 -45.74 84.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.164 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.1 t -65.2 -46.08 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.484 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -63.69 -47.15 82.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.102 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -60.71 -45.27 94.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -65.77 -35.18 90.6 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.421 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.558 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.23 -43.64 81.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.993 0.425 . . . . 0.0 110.53 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.8 mt-10 -60.94 -41.18 95.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.784 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 -59.0 -46.14 88.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.636 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.468 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 83.3 mtp -63.44 -47.07 83.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.921 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 145' ' ' ALA . 83.1 mt -53.01 -47.92 53.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.987 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.42 -35.88 80.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.121 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 98.8 m -58.18 -52.7 64.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.064 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.759 ' HB2' HD13 ' A' ' 163' ' ' LEU . 21.3 m-85 . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.706 0.288 . . . . 0.0 111.377 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.601 0.238 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 152' ' ' TYR . 3.6 mm? -65.55 -40.0 92.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.601 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 152' ' ' TYR . 56.0 tp -57.22 -44.53 83.82 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.542 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.38 -41.25 96.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.248 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.432 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.1 m -59.56 -42.95 93.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.588 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.94 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.711 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.37 -45.82 90.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -66.2 -38.78 88.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.454 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.432 ' HG3' ' O ' ' A' ' 165' ' ' THR . 73.3 mtp -59.94 -48.36 82.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.032 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 57.2 tp -58.42 -46.2 86.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.256 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.87 -43.96 94.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.259 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.69 -45.78 92.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.164 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.57 ' HA ' ' NZ ' ' A' ' 176' ' ' LYS . 80.8 p -61.04 -45.55 94.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.89 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 58.2 mtpt -59.89 -38.66 82.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.018 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.8 m -58.61 -48.05 82.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.963 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 173' ' ' SER . 37.3 mtmm -63.53 -40.54 97.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.876 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.684 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.2 mt -60.32 -40.16 83.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.209 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.92 -47.35 85.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.408 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 63.1 mt -62.73 -48.59 87.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.016 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 64.5 mt -60.68 -40.09 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.605 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -53.87 -45.14 70.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.352 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.52 -39.85 92.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.186 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 9.9 mm100 -62.05 -43.07 99.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.145 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.579 HD11 HD21 ' A' ' 135' ' ' LEU . 9.3 mt -58.75 -51.15 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.104 0.478 . . . . 0.0 110.624 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -57.2 -41.83 80.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.789 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 52.7 ttp85 -64.12 -37.01 85.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.414 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.492 -179.602 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.466 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 18.3 ttp-105 . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.768 0.318 . . . . 0.0 111.082 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 73.7 t -59.14 -50.51 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.418 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.07 85.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.269 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.84 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.14 -44.19 98.46 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.342 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.673 HD13 ' HG ' ' A' ' 184' ' ' LEU . 74.1 mt -66.83 -42.73 85.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.895 0.379 . . . . 0.0 110.882 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.5 mt-10 -62.86 -48.42 79.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.923 -179.347 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.84 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.7 pttp -59.48 -40.59 87.47 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.013 -179.359 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 28.8 mm100 -58.2 -44.71 88.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 110.797 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.6 mt -60.39 -44.66 95.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.29 95.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.319 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 133' ' ' LYS . 74.7 mt -59.79 -42.27 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.638 ' HB3' HD11 ' A' ' 177' ' ' ILE . 66.4 mm-40 -62.41 -41.73 98.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.369 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 98.3 mt -60.42 -40.21 90.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.372 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.55 -48.76 76.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.363 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 49.0 t -67.82 -47.29 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.489 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.4 tttm -59.36 -46.6 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.087 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.04 -46.28 89.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.645 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -60.6 -35.29 89.02 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.966 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.72 -40.5 92.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.872 0.367 . . . . 0.0 110.125 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 94.9 mt-10 -60.23 -42.44 95.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.546 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -59.69 -45.89 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.835 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 88.5 mmm -67.72 -44.29 77.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.249 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.609 HD12 HD12 ' A' ' 170' ' ' LEU . 91.2 mt -61.8 -46.62 96.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.674 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -64.76 -42.91 94.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.816 0.341 . . . . 0.0 111.204 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.5 m -63.34 -48.6 77.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.494 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.527 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 2.1 m-30 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.994 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.935 0.398 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.527 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 94.1 mt -63.26 -35.5 80.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.544 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.562 HD13 ' C ' ' A' ' 163' ' ' LEU . 3.1 tm? -54.49 -58.04 9.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.934 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.0 mt -54.73 -37.09 65.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.4 m -57.54 -50.17 73.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.21 97.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.439 ' OE1' HD13 ' A' ' 149' ' ' ILE . 14.1 mm-40 -57.12 -44.72 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.394 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -37.57 87.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 74.5 mtp -61.15 -50.77 71.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.445 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.609 HD12 HD12 ' A' ' 149' ' ' ILE . 3.5 tt -64.7 -46.74 81.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.682 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 171' ' ' GLN . . . . . 0.479 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 66.2 tt0 -56.49 -44.55 80.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 172' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 176' ' ' LYS . 34.5 t70 -62.15 -42.12 98.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 177' ' ' ILE . 59.9 m -59.69 -48.19 82.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.374 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.479 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 55.2 mtmt -57.22 -49.27 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 111.38 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.4 m -55.59 -46.9 77.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.296 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.505 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 53.6 mtmt -59.6 -40.94 89.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 138' ' ' GLU . 65.4 mt -63.9 -38.45 82.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.015 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -57.57 -48.33 79.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.353 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.56 -40.25 83.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.36 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.47 ' O ' HD13 ' A' ' 184' ' ' LEU . 56.5 mt -57.45 -55.59 20.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.094 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -51.21 -40.04 57.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.007 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.413 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 80.6 mtp -60.03 -39.42 85.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.304 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -68.03 -43.15 79.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.673 ' HG ' HD13 ' A' ' 131' ' ' LEU . 10.0 mp -62.78 -49.58 74.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.365 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.697 ' HD3' ' N ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -60.73 -36.45 78.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.724 0.297 . . . . 0.0 110.451 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.697 ' N ' ' HD3' ' A' ' 185' ' ' ARG . 22.4 tpp180 -65.28 -42.37 93.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.153 179.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.787 179.656 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.817 0.341 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.491 HG12 ' OE2' ' A' ' 132' ' ' GLU . 50.8 t -59.68 -44.02 92.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.11 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -62.55 -41.18 98.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.099 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.49 -39.77 97.78 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.821 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.679 ' O ' ' HG2' ' A' ' 134' ' ' GLN . 84.8 mt -70.71 -38.74 73.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.722 0.296 . . . . 0.0 111.192 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.491 ' OE2' HG12 ' A' ' 128' ' ' VAL . 49.6 mt-10 -67.28 -48.31 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.495 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -63.45 -41.71 98.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.187 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.894 ' HG3' HD13 ' A' ' 180' ' ' ILE . 1.5 pt20 -60.41 -43.11 97.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.897 0.38 . . . . 0.0 110.206 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -54.25 -42.16 69.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -64.76 -37.04 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.765 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 134' ' ' GLN . 69.0 mt -53.37 -49.46 53.31 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.72 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.572 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -61.69 -45.96 91.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.535 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.47 -38.21 71.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.379 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 98.3 mttt -63.45 -51.37 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.254 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.9 t -64.92 -44.18 96.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.246 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.457 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttp -59.23 -46.14 89.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -61.72 -42.3 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.869 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.58 -41.13 97.14 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.585 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.63 -44.59 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 110.293 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 50.3 mt-10 -60.19 -40.27 89.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -57.93 -47.95 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.94 -42.32 81.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.262 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 145' ' ' ALA . 96.2 mt -53.93 -46.88 64.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 95.4 mm-40 -65.2 -39.77 93.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.184 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.6 m -64.68 -46.25 83.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.902 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.724 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.985 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' LYS . . . . . 0.478 ' HD3' ' C ' ' A' ' 161' ' ' LYS . 7.3 tmtm? . . . . . 0 C--O 1.235 0.297 0 CA-C-O 121.015 0.436 . . . . 0.0 109.964 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.724 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 92.9 mt -64.27 -32.68 74.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.216 179.008 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 47.8 tp -56.33 -51.9 66.55 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.31 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.58 -42.85 79.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.4 m -56.55 -41.79 77.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.202 0.525 . . . . 0.0 109.661 178.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.51 76.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.507 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 14.2 mm100 -56.45 -44.35 80.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.138 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.0 tp60 -65.69 -40.19 92.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.124 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.8 mtp -56.73 -47.58 79.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.989 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 54.5 tp -60.32 -45.49 93.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.323 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -59.68 -47.05 87.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.037 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.19 -40.8 97.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.812 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 177' ' ' ILE . 48.8 m -59.97 -45.87 91.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.909 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.5 mtpp -58.84 -41.25 86.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.977 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.6 m -58.77 -44.32 90.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.739 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -62.58 -41.53 99.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.572 HG12 ' HB3' ' A' ' 138' ' ' GLU . 62.1 mt -58.56 -42.9 85.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 178' ' ' ASP . . . . . 0.495 ' HA ' ' HE ' ' A' ' 181' ' ' ARG . 27.2 m-20 -61.44 -41.01 96.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.33 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.86 -44.12 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.127 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.894 HD13 ' HG3' ' A' ' 134' ' ' GLN . 53.5 mt -58.74 -48.79 84.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.806 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.495 ' HE ' ' HA ' ' A' ' 178' ' ' ASP . 84.8 mtm180 -53.96 -40.8 67.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.563 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 25.8 mmt -60.05 -46.54 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.565 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.4 -41.98 90.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.911 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.659 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.3 mm? -61.05 -42.31 98.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.201 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 71.3 mtt-85 -58.01 -51.27 70.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 182' ' ' MET . 10.5 mpt_? -66.04 -36.81 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.812 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.791 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 . . . . . 0 C--O 1.231 0.114 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.27 -48.28 89.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.677 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.97 95.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.569 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.592 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -65.07 -48.53 69.75 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.909 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.664 ' HB3' HD21 ' A' ' 184' ' ' LEU . 90.3 mt -64.94 -41.59 95.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.924 0.393 . . . . 0.0 111.31 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -61.09 -51.09 70.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.864 -179.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 14.8 ptmm? -59.48 -39.21 83.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.239 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.5 mm-40 -58.21 -44.44 88.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.713 0.292 . . . . 0.0 110.999 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.8 mt -58.77 -44.13 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.306 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.75 84.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.436 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.09 -42.49 86.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.354 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.729 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.7 mm-40 -60.06 -43.44 95.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.32 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 88.5 mt -58.42 -43.07 88.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.051 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -59.77 -48.45 81.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.508 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.8 t -68.61 -46.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.524 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 37.4 ttmt -59.25 -49.23 78.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.399 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -63.36 -42.34 98.88 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.809 0.338 . . . . 0.0 110.784 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.79 -39.16 94.99 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.947 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -64.63 -40.05 94.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.106 0.479 . . . . 0.0 109.92 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 142' ' ' LYS . 64.8 mm-40 -59.81 -39.42 84.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.341 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -60.61 -44.05 96.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.231 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 80.5 mtp -67.09 -41.31 86.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.228 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.0 mt -61.14 -49.26 85.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.667 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -68.98 -44.14 73.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.6 m -64.66 -47.09 79.75 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.752 0.311 . . . . 0.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.457 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 1.4 m-30 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.578 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 87.9 tttt . . . . . 0 C--O 1.233 0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 162' ' ' LEU . 3.7 mm? -67.24 -33.85 76.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.001 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -56.57 -44.62 81.15 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.418 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.98 -44.82 91.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.606 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 88.1 m -58.98 -43.12 91.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.916 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -60.47 -41.23 93.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 36.7 mt-30 -59.14 -42.76 91.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.164 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -59.22 -41.22 88.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.436 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.43 ' HB2' ' O ' ' A' ' 166' ' ' ALA . 71.6 mmm -56.42 -45.98 80.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.624 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.508 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 56.9 tp -58.28 -44.64 88.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.047 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -58.45 -43.75 88.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.382 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.48 -47.2 87.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.255 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 80.5 p -64.48 -45.41 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.541 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 29.4 mtpp -57.17 -44.16 83.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.48 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.9 m -59.16 -50.16 75.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 111.047 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -59.21 -42.25 90.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.869 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.729 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -62.07 -34.6 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.028 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -61.2 -50.75 71.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.662 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 179' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.79 -47.23 93.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.485 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.4 mt -58.51 -44.15 88.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.763 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.419 ' HG3' HH11 ' A' ' 181' ' ' ARG . 29.9 tpt85 -53.81 -42.81 68.78 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.345 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.78 -38.9 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.5 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -64.15 -45.22 89.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.042 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.4 mm? -61.67 -53.17 59.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.623 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.69 -39.55 77.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -63.28 -39.94 96.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.703 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.218 -179.886 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.465 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 47.6 ttm-85 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.76 0.314 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.63 -52.05 55.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.894 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.19 -39.27 75.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.374 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.587 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.84 -44.6 97.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.481 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 184' ' ' LEU . 87.9 mt -66.51 -47.59 72.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.015 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -57.31 -49.15 77.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.676 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.591 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -59.96 -36.03 76.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.608 0.242 . . . . 0.0 110.833 -179.731 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.805 ' HB3' HD13 ' A' ' 180' ' ' ILE . 90.5 mm-40 -57.57 -49.29 76.86 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.677 0.275 . . . . 0.0 110.862 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.3 mm? -58.98 -38.44 79.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.981 0.419 . . . . 0.0 110.968 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.44 83.97 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.743 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.462 ' O ' HG23 ' A' ' 141' ' ' VAL . 65.5 mt -65.3 -50.7 71.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.759 -179.414 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.522 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -55.0 -46.53 75.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.808 -179.441 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.8 mt -62.3 -41.07 98.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.721 0.296 . . . . 0.0 110.866 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -62.21 -44.62 96.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.692 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 141' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.8 t -64.91 -43.69 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.974 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.503 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.62 -45.68 93.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.624 179.804 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -62.69 -45.9 90.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.464 179.616 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.3 -37.7 93.46 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.124 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.53 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -64.26 -39.38 93.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.077 0.465 . . . . 0.0 110.014 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -62.84 -46.29 88.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.283 179.324 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -55.89 -40.52 73.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.109 179.346 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.541 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.6 mmm -61.87 -47.31 85.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.747 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 68.9 mt -56.31 -50.84 69.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.929 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.85 -38.72 82.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.495 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.3 m -58.25 -45.93 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.408 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.8 m-85 . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.31 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 161' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 60.8 pttt . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.749 0.309 . . . . 0.0 111.691 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.408 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.2 mt -59.12 -40.75 86.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.37 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 51.7 tp -60.57 -42.78 97.33 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.408 179.877 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 97.3 mt -55.33 -41.26 72.19 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.022 0.439 . . . . 0.0 109.95 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.417 ' O ' ' HG2' ' A' ' 169' ' ' MET . 89.4 m -60.38 -45.02 95.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.89 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.76 -45.47 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.395 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -56.13 -44.36 79.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 98.2 mm-40 -62.37 -38.04 88.03 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.452 179.13 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 165' ' ' THR . 72.5 mmm -62.39 -46.09 90.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.132 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.53 HD23 ' HB3' ' A' ' 145' ' ' ALA . 3.2 tm? -58.97 -46.76 87.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.784 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.54 -43.13 85.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.172 -179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -60.98 -45.07 96.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.082 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.531 ' O ' HG13 ' A' ' 177' ' ' ILE . 85.1 p -58.46 -45.31 88.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.871 -179.767 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -57.17 -42.67 81.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.754 179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 79.7 m -59.57 -44.36 93.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.585 179.623 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.2 mtpp -61.08 -41.92 97.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.48 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 173' ' ' SER . 64.4 mt -58.53 -41.02 80.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.836 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.41 -46.09 91.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.369 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.11 -46.16 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.437 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.805 HD13 ' HB3' ' A' ' 134' ' ' GLN . 69.8 mt -59.17 -40.61 81.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.29 179.28 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -55.24 -42.55 73.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.375 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -61.75 -40.47 95.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.459 179.408 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -64.44 -41.65 96.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 131' ' ' LEU . 4.5 mm? -64.38 -50.95 65.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.595 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -57.86 -44.74 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.654 0.264 . . . . 0.0 111.166 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -64.44 -41.46 96.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.343 . . . . 0.0 110.953 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.001 179.895 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 19.7 ttm105 . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.824 0.345 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.04 -49.82 73.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.978 -179.429 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.01 95.86 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 -179.051 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.09 -51.44 56.86 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.796 -179.619 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 184' ' ' LEU . 88.7 mt -65.77 -38.2 88.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.845 0.355 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -62.06 -49.07 77.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.916 -179.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.498 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -61.72 -40.76 96.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.045 -179.377 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.792 ' HB3' HD13 ' A' ' 180' ' ' ILE . 50.0 mm-40 -58.56 -44.93 89.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.747 0.308 . . . . 0.0 110.836 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' HE ' ' A' ' 181' ' ' ARG . 98.6 mt -62.53 -36.4 82.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.136 0.494 . . . . 0.0 111.041 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 136' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -67.4 -48.57 66.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.433 -179.786 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.46 -47.33 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.936 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.538 ' CG ' HG12 ' A' ' 177' ' ' ILE . 12.2 pt-20 -58.28 -39.61 79.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.15 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.497 ' C ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -70.18 -39.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.53 -179.925 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 68.4 mttm -59.34 -48.04 83.14 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.818 0.342 . . . . 0.0 110.735 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.46 -40.89 87.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.532 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.1 tttm -59.67 -44.49 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.737 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -65.24 -42.38 93.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.56 -40.94 95.22 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.476 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.462 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.64 -40.65 92.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.307 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.27 -39.78 94.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 179.507 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -59.06 -44.13 91.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.492 179.556 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.88 -45.67 88.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.088 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 145' ' ' ALA . 68.4 mt -57.88 -47.06 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.33 -47.58 73.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.765 -179.483 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 92.6 m -61.26 -47.84 84.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.898 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.611 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.5 m-85 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.997 -179.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 27.4 tptp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.668 0.271 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 162' ' ' LEU . . . . . 0.611 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 93.0 mt -64.38 -34.92 79.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.91 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 56.8 tp -55.28 -48.93 73.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.759 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.41 -42.33 98.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.397 179.681 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.8 m -59.02 -42.03 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.972 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.4 94.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -57.5 -44.64 85.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.273 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -61.33 -40.38 94.0 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.475 179.241 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.9 mtp -58.77 -47.66 83.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.441 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.897 HD22 ' HE3' ' A' ' 174' ' ' LYS . 2.0 tt -60.87 -40.69 93.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.963 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -59.49 -41.46 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 179.479 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -61.68 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.839 179.869 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 177' ' ' ILE . 94.1 p -59.1 -40.21 84.64 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.384 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.897 ' HE3' HD22 ' A' ' 170' ' ' LEU . 99.6 mttt -57.29 -44.19 83.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.388 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.2 m -59.82 -48.13 82.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.36 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.565 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 3.4 mmmp? -62.28 -47.32 84.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.992 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.538 HG12 ' CG ' ' A' ' 138' ' ' GLU . 60.6 mt -57.62 -46.31 86.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.71 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -58.84 -47.3 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.663 0.268 . . . . 0.0 111.532 -179.56 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.65 -50.58 75.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.9 -179.417 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.792 HD13 ' HB3' ' A' ' 134' ' ' GLN . 66.0 mt -61.3 -44.41 98.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.558 ' HE ' HD22 ' A' ' 135' ' ' LEU . 19.4 mmt85 -56.22 -40.83 74.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.805 0.336 . . . . 0.0 110.509 179.602 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.0 tpp -59.96 -43.4 95.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.272 179.291 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.94 -40.29 97.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.679 179.517 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -62.25 -44.24 96.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.685 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 185' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 78.0 mtp180 -57.6 -43.9 85.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.619 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 186' ' ' ARG . 43.0 mmm-85 -62.33 -42.26 99.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.036 -179.997 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.409 ' HG2' HH11 ' A' ' 127' ' ' ARG . 15.2 tpp85 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.687 0.28 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.8 -41.29 75.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.772 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.24 74.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.332 179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.847 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.86 -57.79 15.88 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.132 179.652 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.857 HD23 HD12 ' A' ' 184' ' ' LEU . 6.8 mp -53.63 -46.12 70.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -58.05 -55.0 40.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.681 0.277 . . . . 0.0 111.478 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.847 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.3 pttp -60.79 -34.16 74.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.895 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.797 ' HB3' HD13 ' A' ' 180' ' ' ILE . 45.3 mm-40 -60.64 -50.21 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.247 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.6 mm? -55.61 -43.5 76.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.843 0.354 . . . . 0.0 111.094 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.99 79.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 137' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 133' ' ' LYS . 68.5 mt -63.16 -42.53 96.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.581 -179.682 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.716 ' HB3' HD11 ' A' ' 177' ' ' ILE . 69.0 mm-40 -59.09 -44.88 91.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.43 -179.601 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.3 mt -60.32 -40.71 91.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.773 0.32 . . . . 0.0 111.001 -179.873 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -62.11 -50.13 73.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.493 -179.795 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.75 -49.96 64.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.993 -179.34 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.9 tttt -57.57 -44.86 85.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.338 -179.433 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -57.87 -51.21 70.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.496 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.39 -34.83 86.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.542 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.23 -40.95 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.983 0.42 . . . . 0.0 110.421 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -60.71 -43.72 97.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.743 179.706 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.23 -43.37 98.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.933 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 84.1 mtp -63.33 -47.26 82.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.965 179.899 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.1 mt -56.68 -47.95 81.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -65.12 -40.03 93.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.039 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.4 m -56.87 -46.03 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.627 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.494 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.341 -179.726 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 CA--C 1.528 0.134 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 77.3 mt -61.17 -45.85 92.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.226 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 152' ' ' TYR . 57.3 tp -60.33 -45.65 92.68 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.0 -0.28 . . . . 0.0 111.119 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 164' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 168' ' ' GLN . 94.8 mt -57.27 -37.26 72.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.774 0.321 . . . . 0.0 110.712 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 165' ' ' THR . . . . . 0.48 ' O ' ' HG3' ' A' ' 169' ' ' MET . 88.4 m -61.81 -47.52 84.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.163 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 166' ' ' ALA . . . . . 0.405 ' HB2' ' HE2' ' A' ' 148' ' ' MET . . . -68.15 -49.18 62.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.446 -179.902 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.413 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 25.9 mt-30 -56.96 -36.4 70.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 109.989 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 168' ' ' GLN . . . . . 0.558 ' HB2' ' O ' ' A' ' 164' ' ' LEU . 0.5 OUTLIER -62.21 -45.91 91.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.997 179.63 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 169' ' ' MET . . . . . 0.48 ' HG3' ' O ' ' A' ' 165' ' ' THR . 58.8 mtm -60.48 -39.33 87.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.9 tm? -60.77 -42.04 96.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.437 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 171' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 12.0 mm100 -64.96 -47.52 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.524 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -64.08 -42.27 97.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.816 -179.356 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.526 ' O ' HG13 ' A' ' 177' ' ' ILE . 86.2 p -57.83 -47.53 82.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.33 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -60.92 -48.01 83.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.607 -179.627 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.7 m -58.04 -48.6 79.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.707 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.486 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 54.6 mtmt -59.28 -43.64 92.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.047 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.716 HD11 ' HB3' ' A' ' 138' ' ' GLU . 72.2 mt -60.9 -35.57 65.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.183 179.919 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 178' ' ' ASP . . . . . 0.551 ' O ' ' HG2' ' A' ' 182' ' ' MET . 65.2 m-20 -62.25 -49.82 74.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.686 0.279 . . . . 0.0 110.806 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 39.9 mm -62.42 -50.17 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.038 0.447 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.797 HD13 ' HB3' ' A' ' 134' ' ' GLN . 88.4 mt -55.37 -49.92 69.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.277 179.555 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.718 ' HA ' HD13 ' A' ' 184' ' ' LEU . 79.5 ttt180 -49.47 -40.27 36.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.348 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.4 mmt -57.8 -41.06 81.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.867 178.951 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 183' ' ' GLN . . . . . 0.548 ' CB ' HD21 ' A' ' 131' ' ' LEU . 85.2 mt-30 -66.62 -36.91 83.73 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.057 179.482 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.857 HD12 HD23 ' A' ' 131' ' ' LEU . 6.8 mp -61.29 -56.95 14.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.728 0.299 . . . . 0.0 111.28 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.47 -43.23 97.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.747 -179.189 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 186' ' ' ARG . 15.0 tpp85 -60.12 -44.97 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.803 0.335 . . . . 0.0 110.987 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.479 -179.822 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 127' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 20.7 ttm105 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.726 0.298 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.471 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 60.7 t -58.55 -45.94 90.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.995 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 179.734 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 130' ' ' GLY . . . . . 0.718 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -62.09 -40.61 99.17 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.333 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 89.0 mt -67.34 -42.75 83.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.898 0.38 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 67.7 mm-40 -63.79 -46.8 83.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.75 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.718 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -59.98 -41.19 91.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.661 0.267 . . . . 0.0 111.229 -179.316 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 134' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 30.8 mm100 -59.32 -46.24 89.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 135' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 60.0 tp -61.42 -41.93 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.844 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.88 85.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.285 -179.763 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -59.15 -42.41 86.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.708 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 138' ' ' GLU . . . . . 0.662 ' HB3' HD11 ' A' ' 177' ' ' ILE . 65.0 mm-40 -61.97 -40.05 94.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.129 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 139' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.6 mt -59.8 -42.4 93.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.209 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.83 -49.19 71.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.189 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.68 -46.93 93.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.166 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 142' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.8 tttm -61.88 -44.16 97.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.629 179.961 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -58.69 -44.84 90.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.06 179.675 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 144' ' ' GLY . . . . . 0.465 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -65.16 -35.08 91.27 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 145' ' ' ALA . . . . . 0.536 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.58 -41.09 89.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.542 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.0 mt-10 -61.72 -42.54 99.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.687 179.722 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -61.99 -39.44 92.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.523 179.591 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 148' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.8 mtp -67.81 -41.49 83.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.274 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 149' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 145' ' ' ALA . 73.5 mt -63.33 -47.5 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.439 -179.564 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 150' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 3.1 pt20 -68.83 -45.36 71.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.768 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -66.04 -48.35 71.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.873 -179.377 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 152' ' ' TYR . . . . . 0.492 ' O ' HD13 ' A' ' 163' ' ' LEU . 1.4 m-85 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.832 -179.518 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt . . . . . 0 N--CA 1.461 0.078 0 CA-C-O 120.67 0.272 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.75 -40.33 96.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.059 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 163' ' ' LEU . . . . . 0.492 HD13 ' O ' ' A' ' 152' ' ' TYR . 62.3 tp -57.43 -48.02 80.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.832 0.348 . . . . 0.0 110.578 179.739 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.9 -39.63 94.62 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.166 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.8 m -56.47 -44.61 80.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.658 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.44 -41.3 98.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 167' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.2 mt-30 -58.03 -42.53 85.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.153 179.61 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -59.36 -40.03 85.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.768 179.119 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.1 mtp -59.92 -47.31 86.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.634 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 170' ' ' LEU . . . . . 0.489 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.1 tm? -57.4 -47.49 81.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.675 -179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -60.59 -42.04 95.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -57.46 -46.41 83.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 173' ' ' SER . . . . . 0.512 ' O ' HG13 ' A' ' 177' ' ' ILE . 51.1 m -62.09 -42.97 99.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 -179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 174' ' ' LYS . . . . . 0.577 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.54 -42.99 84.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.492 -179.723 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.7 m -61.37 -48.73 79.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.406 -179.634 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 176' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 180' ' ' ILE . 68.3 mttm -62.87 -46.59 87.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.196 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 177' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' A' ' 138' ' ' GLU . 54.6 mt -59.99 -40.23 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.138 -179.776 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 178' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 182' ' ' MET . 8.2 t70 -58.03 -44.67 87.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.001 0.429 . . . . 0.0 109.99 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.99 -43.05 97.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.926 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 71.3 mt -59.88 -46.78 93.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.129 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 73.1 mtt-85 -55.48 -44.2 76.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 182' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 92.2 mmm -59.69 -37.5 78.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.491 179.577 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -67.34 -38.93 85.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.089 179.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 184' ' ' LEU . . . . . 0.48 HD22 HD13 ' A' ' 131' ' ' LEU . 9.2 mt -60.49 -53.95 51.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.179 0.514 . . . . 0.0 110.768 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.2 -43.02 96.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.179 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 186' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 186' ' ' ARG . 46.1 ttm-85 -62.3 -36.11 81.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.129 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.414 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.682 -179.59 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 112.496 -0.241 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.527 HG12 ' ND2' ' A' ' 124' ' ' ASN . 36.3 pt -63.91 138.38 97.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.563 0.221 . . . . 0.0 111.307 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 13.1 Cg_exo -69.8 70.04 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.915 2.41 . . . . 0.0 112.222 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . -154.97 -134.68 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.266 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 67.1 p -58.86 -37.02 75.58 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.527 ' ND2' HG12 ' A' ' 120' ' ' ILE . 42.0 m-20 -53.94 -55.18 29.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.66 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 96.7 mt 53.05 30.79 10.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.173 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 56.8 m -75.82 -56.42 4.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.9 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -68.96 -40.93 78.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.934 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 84.3 t -61.2 -45.7 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.58 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.98 -43.88 97.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.47 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.71 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -60.85 -50.67 65.01 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.01 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.469 HD13 HD22 ' A' ' 184' ' ' LEU . 93.4 mt -67.26 -40.2 86.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.82 0.343 . . . . 0.0 111.427 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -62.67 -47.15 84.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.575 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.71 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.8 pttt -60.85 -41.64 96.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.598 0.237 . . . . 0.0 111.116 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.586 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 31.0 mm100 -57.42 -44.66 84.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.901 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -61.31 -41.83 97.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.403 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.46 -45.71 90.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.23 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.2 -41.32 83.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.908 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.526 ' HB3' ' CD1' ' A' ' 177' ' ' ILE . 62.1 mm-40 -57.95 -44.28 86.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.015 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.5 mt -61.3 -39.5 90.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.225 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -62.2 -47.84 82.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.5 t -72.53 -48.31 47.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.0 tttp -60.29 -54.98 39.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.158 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -61.79 -38.8 89.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.34 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.57 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.95 -40.83 98.97 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.503 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.98 -42.11 81.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 110.568 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 49.7 mt-10 -62.5 -42.32 99.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 45.2 t30 -60.61 -40.18 90.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.776 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.3 mmm -67.93 -45.25 74.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.021 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.6 mt -57.09 -49.72 78.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.659 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -63.59 -41.33 98.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.411 -179.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 95.1 m -60.14 -44.5 94.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 162' ' ' LEU . 7.3 m-30 -58.43 -42.85 88.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 59.2 m -60.85 -32.76 72.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.281 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -53.63 -59.95 3.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.596 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLY . . . . . 0.642 ' HA2' ' HE3' ' A' ' 158' ' ' LYS . . . 157.79 -35.07 0.54 Allowed Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.284 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.7 t -49.54 -81.3 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.663 HG22 ' H ' ' A' ' 159' ' ' ASP . 87.3 m -68.07 -67.78 0.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.833 0.349 . . . . 0.0 111.021 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.642 ' HE3' ' HA2' ' A' ' 155' ' ' GLY . 39.6 ttmt 51.72 28.99 5.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.673 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.663 ' H ' HG22 ' A' ' 157' ' ' THR . 59.3 m-20 -75.22 128.63 35.9 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.611 0.244 . . . . 0.0 110.579 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -70.63 -48.26 55.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.321 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 39.4 ttpt -58.22 -46.6 85.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.976 0.417 . . . . 0.0 110.571 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.552 ' HB3' ' CE2' ' A' ' 152' ' ' TYR . 4.5 mm? -67.02 -34.82 78.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.108 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.0 tp -56.13 -54.18 48.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.381 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.636 HD12 ' N ' ' A' ' 165' ' ' THR . 4.3 pp -64.29 -38.49 91.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.782 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.636 ' N ' HD12 ' A' ' 164' ' ' LEU . 84.9 m -55.63 -46.02 77.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.961 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.61 94.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 36.3 mt-30 -56.35 -46.42 79.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.572 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -62.55 -41.15 98.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.044 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 73.5 mtp -57.44 -47.94 80.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.519 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.44 -44.17 97.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.624 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' GLN . . . . . 0.895 ' HA ' ' HE3' ' A' ' 174' ' ' LYS . 85.7 mt-30 -59.07 -49.49 77.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -66.98 -41.09 87.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.784 0.326 . . . . 0.0 111.321 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.62 ' O ' HG13 ' A' ' 177' ' ' ILE . 58.2 m -62.42 -50.84 69.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.026 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.895 ' HE3' ' HA ' ' A' ' 171' ' ' GLN . 22.0 pttp -60.29 -40.09 89.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' THR . . . . . 0.509 ' O ' HG13 ' A' ' 179' ' ' ILE . 85.0 m -58.18 -47.55 83.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.045 0.45 . . . . 0.0 111.057 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.04 -34.9 77.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 173' ' ' SER . 21.7 mt -60.66 -49.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.713 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -59.94 -36.43 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 110.227 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 175' ' ' THR . 61.4 mt -61.96 -48.37 88.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.475 HD13 ' HB3' ' A' ' 134' ' ' GLN . 68.0 mt -61.93 -41.08 89.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -55.31 -43.86 75.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.444 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.7 ttm -60.91 -41.04 95.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.185 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -59.23 -40.67 86.61 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 131' ' ' LEU . 11.9 mt -58.23 -54.67 44.32 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.712 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.492 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 47.9 mtp85 -54.75 -41.98 71.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.39 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.409 HH11 ' HG2' ' A' ' 186' ' ' ARG . 53.7 ttt-85 -62.8 -34.65 77.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.712 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.74 91.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.128 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.47 -40.01 89.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.362 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.492 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 86.4 mt-30 -60.29 -45.71 92.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.371 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.4 -47.0 77.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.629 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.74 -44.21 96.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.424 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.487 ' O ' ' HB3' ' A' ' 193' ' ' LEU . 53.4 tt0 -60.3 -53.86 52.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.307 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.487 ' HB3' ' O ' ' A' ' 192' ' ' GLN . 61.6 tp 73.33 -52.06 0.7 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.459 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 59.43 106.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.826 0.346 . . . . 0.0 111.122 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.415 ' HB3' ' H ' ' A' ' 196' ' ' GLN . 3.5 m120 50.44 -152.23 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.787 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 196' ' ' GLN . . . . . 0.415 ' H ' ' HB3' ' A' ' 195' ' ' ASN . 64.2 tp60 -74.53 136.64 42.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.797 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -59.2 135.1 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -59.57 133.8 88.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.16 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo . . . . . 0 C--O 1.248 1.004 0 C-N-CA 122.529 2.153 . . . . 0.0 112.209 179.895 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.124 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.56 HG22 ' H ' ' A' ' 123' ' ' THR . 49.5 mm -62.11 129.39 92.01 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.588 0.232 . . . . 0.0 111.026 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -63.89 -46.5 8.47 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.369 2.046 . . . . 0.0 111.9 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.519 ' HB1' ' HG ' ' A' ' 125' ' ' LEU . . . -64.18 -35.27 80.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.56 ' H ' HG22 ' A' ' 120' ' ' ILE . 14.9 m 66.82 46.36 1.69 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.926 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 125' ' ' LEU . 3.1 m120 73.06 -42.35 0.53 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.139 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.519 ' HG ' ' HB1' ' A' ' 122' ' ' ALA . 94.2 mt 74.57 -42.13 0.49 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.521 0.329 . . . . 0.0 111.514 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.1 p -65.16 -49.74 68.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.666 0.27 . . . . 0.0 111.239 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.445 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 99.8 mtt180 -62.91 -42.16 99.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.228 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.3 t -56.98 -51.87 63.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.375 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.25 -40.79 97.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.114 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.833 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.39 -43.97 98.65 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.522 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 184' ' ' LEU . 93.3 mt -67.5 -41.18 84.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.779 0.323 . . . . 0.0 111.197 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.2 mm-40 -63.73 -48.58 76.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.77 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.833 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.9 pttt -59.53 -41.53 90.23 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.014 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.67 -39.33 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.958 0.409 . . . . 0.0 110.686 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.589 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.6 tm? -58.95 -41.74 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.392 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.92 89.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.157 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.477 ' O ' HG23 ' A' ' 141' ' ' VAL . 68.7 mt -65.39 -48.04 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.194 -179.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 12.2 pt-20 -59.1 -45.4 90.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.375 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.98 -39.04 90.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.626 0.251 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -60.45 -44.29 95.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.209 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.0 t -66.26 -46.97 85.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.577 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.529 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 40.3 ttmt -61.63 -46.81 88.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.276 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 33.8 tp60 -62.69 -48.91 77.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.641 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.52 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.55 -34.62 86.63 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.753 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.87 -44.64 76.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.873 0.368 . . . . 0.0 110.348 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 51.7 mt-10 -60.15 -41.78 93.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.87 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASN . . . . . 0.428 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 20.1 t-20 -59.04 -43.77 91.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.341 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.523 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.8 mmm -67.5 -45.37 76.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.6 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.599 HG13 ' O ' ' A' ' 145' ' ' ALA . 89.6 mt -52.88 -53.77 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.407 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 147' ' ' ASN . 22.3 pt20 -58.99 -36.55 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.033 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 54.9 m -54.93 -54.96 36.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.862 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.605 ' HB2' HD13 ' A' ' 163' ' ' LEU . 37.1 m-85 -75.28 -29.06 60.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.642 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 74.3 m -54.44 -40.71 68.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.979 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -136.09 -41.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -59.4 134.85 51.71 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.167 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 80.5 p -59.23 129.27 41.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.911 0.386 . . . . 0.0 111.137 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.501 HG22 ' H ' ' A' ' 159' ' ' ASP . 98.4 m -164.42 -40.27 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.673 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 157' ' ' THR . 63.4 tttp 70.48 -24.87 0.16 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.501 ' H ' HG22 ' A' ' 157' ' ' THR . 32.0 m-20 -72.99 60.5 0.54 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.541 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 45.7 ttt85 -54.5 -29.47 50.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.255 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -53.32 -46.77 69.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.036 0.446 . . . . 0.0 110.523 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 98.8 mt -61.02 -36.39 79.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.004 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.605 HD13 ' HB2' ' A' ' 152' ' ' TYR . 39.9 tp -57.37 -46.42 83.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.104 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.54 -42.75 75.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.417 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.568 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.7 m -57.19 -42.74 81.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.819 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -71.0 -35.83 72.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.297 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 13.0 mm-40 -56.92 -48.82 77.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.991 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 165' ' ' THR . 19.4 pt20 -65.45 -41.37 93.49 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.162 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.8 mtm -59.51 -38.18 80.26 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-O 120.865 0.364 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.6 -45.43 94.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -59.8 -50.85 72.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.17 -39.55 93.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 43.1 t -56.86 -44.75 82.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.82 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 55.9 mtpt -61.06 -44.54 97.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.625 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -56.03 -41.69 75.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.88 -45.52 93.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.05 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.546 HG12 ' CD ' ' A' ' 138' ' ' GLU . 28.5 mt -57.85 -41.78 80.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.942 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.59 -49.31 73.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.754 0.311 . . . . 0.0 111.435 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 64.6 mt -62.12 -50.29 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.32 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -59.13 -43.97 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -53.55 -41.09 66.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.273 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.429 ' SD ' ' HD3' ' A' ' 185' ' ' ARG . 48.0 tpp -62.62 -38.24 89.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.306 179.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.69 -44.09 94.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.259 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -58.36 -55.27 37.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.496 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 16.0 ptm180 -58.85 -38.63 79.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.727 0.299 . . . . 0.0 110.594 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -57.74 -40.45 79.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.739 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.35 -46.09 90.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.41 HD23 ' O ' ' A' ' 184' ' ' LEU . 4.1 mm? -64.28 -41.66 96.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.41 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 72.8 mt-30 -59.41 -48.03 83.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.309 . . . . 0.0 111.056 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.09 -43.14 88.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -61.06 -38.7 87.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.289 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 192' ' ' GLN . 63.0 tt0 -78.04 46.16 0.57 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.155 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.469 HD13 ' N ' ' A' ' 194' ' ' GLU . 2.0 tm? -175.82 122.68 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.126 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' A' ' 195' ' ' ASN . 31.0 tp10 -76.49 -128.23 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.534 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.505 ' H ' ' HG3' ' A' ' 194' ' ' GLU . 45.4 t30 -177.94 -50.73 0.01 OUTLIER 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.863 0.363 . . . . 0.0 110.539 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -71.29 139.51 49.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.0 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.08 130.34 45.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -174.25 137.64 0.65 Allowed Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.979 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 C--O 1.249 1.044 0 C-N-CA 122.569 2.179 . . . . 0.0 112.236 179.839 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 12.4 tt -174.16 132.37 0.53 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-O 120.616 0.246 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.48 -53.76 3.68 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.512 2.141 . . . . 0.0 112.126 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.664 ' HB3' HD11 ' A' ' 125' ' ' LEU . . . -72.07 144.03 48.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 81.1 p -53.74 -50.22 66.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.381 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.438 ' C ' HD12 ' A' ' 125' ' ' LEU . 16.6 t-20 -178.33 140.11 0.21 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.79 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.664 HD11 ' HB3' ' A' ' 122' ' ' ALA . 4.0 mp -125.26 -33.09 2.89 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.229 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 77.9 p -47.55 -42.93 24.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.851 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.488 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 6.5 tpm_? -65.46 -47.0 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 89.6 t -63.53 -52.57 56.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.898 0.38 . . . . 0.0 111.54 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.77 85.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.505 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.552 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.41 -44.42 97.64 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.572 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 184' ' ' LEU . 94.8 mt -67.88 -41.0 83.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.851 0.358 . . . . 0.0 111.074 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 95.3 mt-10 -64.18 -49.19 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.537 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.463 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -57.2 -39.48 75.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.765 0.317 . . . . 0.0 110.608 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 95.0 mm-40 -58.29 -46.07 86.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.562 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 95.5 mt -54.62 -44.48 73.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.03 99.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.345 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.9 mt -59.74 -48.82 86.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.317 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.428 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.0 OUTLIER -55.67 -45.38 77.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.694 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 48.0 mt -62.35 -38.51 89.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -63.01 -42.81 99.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 0.0 110.479 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.69 -46.36 82.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.208 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.739 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 38.9 ttmt -61.01 -49.47 77.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -62.34 -43.55 98.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.449 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.68 -36.26 89.03 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.883 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.524 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.17 -41.77 80.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.96 0.409 . . . . 0.0 110.568 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.4 mt-10 -60.06 -44.57 94.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.999 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASN . . . . . 0.544 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 19.3 t-20 -61.8 -44.86 96.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.554 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.5 mtp -61.0 -40.76 94.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 145' ' ' ALA . 85.3 mt -61.21 -51.07 77.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 147' ' ' ASN . 0.0 OUTLIER -66.85 -30.47 70.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.713 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.7 m -64.59 -50.61 66.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.54 -36.7 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.86 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 47.5 t -53.58 -40.2 65.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.384 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 38.7 m-20 -59.85 156.5 14.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.468 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -47.26 -45.49 21.34 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.981 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 48.2 t -70.81 122.18 19.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.574 0.226 . . . . 0.0 111.015 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 84.9 m 61.66 133.64 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.553 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.58 ' NZ ' ' HB2' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -173.54 42.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.276 179.741 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.78 130.91 47.01 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.419 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -68.2 -44.66 75.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.581 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.525 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 8.4 ptpp? -57.82 -47.82 81.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.751 0.31 . . . . 0.0 110.973 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.95 -35.92 72.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.819 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.501 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -57.03 -51.26 69.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.094 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 165' ' ' THR . 4.2 pp -65.03 -38.52 91.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.627 ' N ' HD12 ' A' ' 164' ' ' LEU . 89.7 m -55.63 -45.19 77.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.46 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -63.71 -40.68 97.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.325 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.6 mt-30 -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.934 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -60.69 -41.28 94.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.96 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.6 mtp -59.71 -47.48 85.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.477 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.546 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 60.7 tp -57.03 -44.47 82.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' GLN . . . . . 0.564 ' HA ' ' NZ ' ' A' ' 174' ' ' LYS . 65.8 tt0 -61.64 -43.14 99.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.081 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.41 -43.93 96.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.417 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.5 ' O ' HG13 ' A' ' 177' ' ' ILE . 89.3 p -62.29 -45.58 92.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.435 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.739 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 10.4 mtmp? -57.66 -49.64 75.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.6 m -55.73 -43.34 76.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.282 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.93 -41.01 97.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.072 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 173' ' ' SER . 64.1 mt -58.48 -41.07 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.025 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.6 -46.15 83.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.184 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 182' ' ' MET . 51.0 mm -62.93 -43.87 99.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.08 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.6 ' O ' HD23 ' A' ' 184' ' ' LEU . 72.9 mt -65.64 -40.73 88.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 110.501 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.507 ' HE ' ' NH2' ' A' ' 185' ' ' ARG . 78.4 ttt180 -52.06 -52.11 53.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.393 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 21.2 ptp -62.79 -39.77 95.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 86.4 mt-30 -55.27 -43.88 75.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.717 0.294 . . . . 0.0 110.483 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.4 mm? -61.53 -39.28 90.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.507 ' NH2' ' HE ' ' A' ' 181' ' ' ARG . 21.5 mmt85 -55.85 -58.16 9.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.417 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.439 HH11 ' HG2' ' A' ' 186' ' ' ARG . 0.6 OUTLIER -67.23 -32.78 74.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.406 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.54 95.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 111.044 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 99.1 mt -69.96 -45.34 67.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.365 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 48.0 mm-40 -62.02 -46.68 88.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.652 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.97 75.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.604 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -61.66 -48.98 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.917 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -69.08 -115.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 31.5 tp 64.48 41.11 5.81 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 121.157 0.503 . . . . 0.0 110.348 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 194' ' ' GLU . 37.4 tt0 -177.84 35.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.035 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -178.05 135.28 0.16 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.486 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -57.6 133.91 55.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.55 139.14 57.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.165 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . -169.54 137.13 1.48 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.044 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 37.5 Cg_exo . . . . . 0 C--O 1.249 1.075 0 C-N-CA 122.601 2.201 . . . . 0.0 112.262 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 48.7 mt 58.13 66.43 2.7 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-O 120.761 0.315 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 122' ' ' ALA . 47.7 Cg_endo -67.5 -135.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.6 2.2 . . . . 0.0 112.247 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.426 ' H ' ' HB2' ' A' ' 121' ' ' PRO . . . -57.84 -46.14 85.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.764 0.316 . . . . 0.0 111.072 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.403 HG22 ' HG2' ' A' ' 121' ' ' PRO . 5.9 t -63.57 126.81 28.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.051 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 44.8 t30 179.17 -41.52 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.379 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.06 -37.41 71.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.831 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.4 t -59.83 -40.67 89.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.801 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 15.5 tpp85 -66.88 -48.81 67.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.316 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.1 t -61.85 -54.85 29.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.363 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.83 -38.07 86.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.104 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.601 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.23 -45.27 96.38 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.524 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.58 ' HB3' HD21 ' A' ' 184' ' ' LEU . 93.3 mt -67.88 -43.9 78.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.709 0.29 . . . . 0.0 111.155 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 58.4 mm-40 -60.11 -48.27 82.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.672 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -60.19 -40.81 91.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.179 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.8 mm100 -56.68 -45.01 82.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.692 0.282 . . . . 0.0 110.923 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.9 tp -60.12 -42.73 95.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.893 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.74 96.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.8 mt -59.47 -42.3 87.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.8 mm-40 -58.59 -43.98 89.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.2 mt -60.11 -38.26 82.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.498 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 13.0 tmtt? -63.59 -52.85 59.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.228 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.1 -45.27 87.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.748 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.423 ' HE2' ' HD3' ' A' ' 174' ' ' LYS . 62.8 tttm -58.05 -45.77 86.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.056 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -64.06 -47.91 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.195 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.31 -32.16 79.8 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.822 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.644 ' O ' HG12 ' A' ' 149' ' ' ILE . . . -66.17 -43.99 85.32 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.105 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.6 mt-10 -58.96 -40.83 85.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.343 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -58.5 -42.63 88.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 83.5 mtp -66.4 -45.85 78.6 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.604 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 145' ' ' ALA . 43.0 mm -54.65 -42.91 63.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.688 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -72.62 -41.78 65.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.188 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 67.2 m -56.71 -52.86 63.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.86 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.414 ' HA ' ' O ' ' A' ' 157' ' ' THR . 24.8 m-85 -71.78 -42.68 66.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.942 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 41.3 t -54.89 120.9 7.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 20.7 p30 46.52 -164.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.043 -179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 45.68 46.47 13.07 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.78 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.492 ' HA ' ' HE3' ' A' ' 158' ' ' LYS . 36.3 t 62.62 179.09 0.14 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.7 0.286 . . . . 0.0 110.925 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.414 ' O ' ' HA ' ' A' ' 152' ' ' TYR . 77.3 p 51.06 38.64 21.21 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.676 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.875 ' HD2' ' H ' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -88.49 45.96 1.34 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.359 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 163' ' ' LEU . 56.2 m-20 -57.8 127.13 30.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 110.508 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.401 HH11 ' HG3' ' A' ' 160' ' ' ARG . 20.9 mmt85 -71.08 -47.71 56.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.824 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -55.14 -50.89 68.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.234 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.408 HD22 ' N ' ' A' ' 162' ' ' LEU . 3.8 mm? -70.07 -35.61 74.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.112 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.1 tp -54.66 -49.2 71.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.858 0.361 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.9 mt -67.04 -35.8 80.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.38 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.6 m -57.59 -47.85 81.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.257 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.56 -46.54 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.089 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 85.4 mt-30 -56.8 -36.99 70.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.154 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.2 tp60 -64.24 -44.24 92.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.821 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 165' ' ' THR . 39.1 mtm -63.2 -42.39 99.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.424 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 49.1 tp -61.22 -46.23 91.3 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -61.09 -44.5 97.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.287 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -57.74 -43.26 85.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.848 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.555 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.0 m -63.13 -43.32 98.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.061 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.4 mmmm -56.07 -51.91 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.516 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.3 m -56.41 -45.87 80.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.679 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 180' ' ' ILE . 34.4 mmtp -62.84 -41.81 99.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.487 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.657 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -59.99 -40.16 82.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.355 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.6 -46.06 90.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.681 ' O ' ' HG3' ' A' ' 182' ' ' MET . 67.0 mt -63.22 -44.15 99.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.928 0.394 . . . . 0.0 110.761 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.579 ' O ' HD23 ' A' ' 184' ' ' LEU . 69.7 mt -63.99 -38.2 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.897 0.38 . . . . 0.0 110.369 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 181' ' ' ARG . 40.3 ttt85 -54.93 -49.27 71.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.251 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 4.5 ppp? -65.54 -32.9 74.74 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.564 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 36.4 mt-30 -61.03 -47.25 87.28 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.851 0.357 . . . . 0.0 110.576 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.58 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -60.19 -43.92 95.5 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.669 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 48.3 mtp85 -54.44 -44.19 72.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.601 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -63.79 -36.21 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.917 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.41 -45.43 93.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.018 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.532 ' O ' ' HG3' ' A' ' 192' ' ' GLN . 9.6 mp -65.81 -43.31 89.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.862 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 35.8 mt-30 -55.85 -45.59 78.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.69 98.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.993 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -63.8 -38.15 90.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.979 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 188' ' ' LEU . 86.4 mt-30 -58.81 -51.61 69.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.34 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.46 -50.5 63.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.786 0.326 . . . . 0.0 111.126 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.98 130.44 43.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.812 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -64.62 142.09 58.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.719 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -57.1 131.58 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.671 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.09 133.51 54.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.285 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.514 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -173.78 56.0 0.19 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.273 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.514 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 41.9 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 122.424 2.083 . . . . 0.0 112.311 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.854 HD12 ' HD2' ' A' ' 121' ' ' PRO . 6.6 tp -60.94 120.62 55.54 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 0.0 110.999 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.854 ' HD2' HD12 ' A' ' 120' ' ' ILE . 83.0 Cg_endo -80.97 46.26 2.22 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.663 2.242 . . . . 0.0 112.874 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -170.73 31.77 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 70.0 p 55.79 149.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.268 0.556 . . . . 0.0 112.311 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 29.4 m-20 -57.01 135.4 56.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.36 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 95.3 mt -146.36 -42.05 0.2 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.141 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.0 t -56.83 -46.38 81.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.05 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.419 ' HG2' HH11 ' A' ' 127' ' ' ARG . 55.1 ttp85 -63.3 -53.08 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.918 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 72.6 t -47.51 -48.71 10.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.532 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.06 -37.23 81.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.583 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -60.2 -58.18 15.34 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.538 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 1.017 HD23 HD22 ' A' ' 184' ' ' LEU . 7.0 mp -53.25 -43.31 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.681 0.277 . . . . 0.0 111.71 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.3 mt-10 -64.36 -50.53 67.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 23.2 pttm -59.94 -37.92 80.92 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 46.5 mm-40 -59.22 -48.79 80.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.296 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 88.0 mt -57.64 -44.14 85.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.636 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -60.93 -49.7 76.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.056 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.83 -48.75 86.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.963 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.582 ' OE2' HD11 ' A' ' 180' ' ' ILE . 0.3 OUTLIER -59.33 -45.4 91.45 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.325 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 86.7 mt -58.66 -41.47 86.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 62.1 mttp -61.81 -49.71 75.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.378 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.36 -46.67 83.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 111.382 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.8 tttt -57.25 -47.35 81.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.051 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -59.07 -42.65 90.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.04 -37.65 94.9 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.188 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 170' ' ' LEU . . . -66.27 -41.17 90.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.1 0.476 . . . . 0.0 110.243 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -63.33 -39.35 94.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.44 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -58.32 -44.61 88.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 179.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.429 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 18.7 mmt -63.64 -48.33 77.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.142 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 145' ' ' ALA . 69.6 mt -55.19 -45.43 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 0.0 111.086 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.99 -39.7 90.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.091 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.5 m -65.37 -52.32 54.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.708 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 148' ' ' MET . 10.0 m-85 -75.61 17.61 0.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.608 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.2 t -71.78 -46.41 58.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.825 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.432 ' HA ' ' CE ' ' A' ' 158' ' ' LYS . 43.4 t30 -176.22 133.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 67.72 155.73 0.62 Allowed Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.825 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 95.1 p 54.68 74.64 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.78 0.324 . . . . 0.0 111.514 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 88.7 m 67.79 140.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.496 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.432 ' CE ' ' HA ' ' A' ' 154' ' ' ASN . 40.3 ttmt -165.8 50.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.569 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.579 ' OD2' HD13 ' A' ' 162' ' ' LEU . 64.1 t0 -61.26 129.21 40.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.372 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -66.98 -43.71 82.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.447 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -57.57 -54.11 50.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.325 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.579 HD13 ' OD2' ' A' ' 159' ' ' ASP . 10.9 mp -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.195 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.3 tp -55.66 -52.55 63.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.886 0.374 . . . . 0.0 110.464 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 87.3 mt -69.56 -37.14 76.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.491 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.45 ' O ' ' HG3' ' A' ' 169' ' ' MET . 94.6 m -55.52 -44.66 76.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.841 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.49 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.564 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -58.29 -38.11 76.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.149 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 94.5 mm-40 -63.62 -42.72 98.15 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.037 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.6 mtm -64.17 -40.43 96.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 49.3 tp -62.55 -42.88 99.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.984 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -58.79 -45.39 89.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.767 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -60.61 -41.46 94.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.727 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.7 m -62.05 -42.35 99.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.945 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.7 mtpp -57.91 -44.38 86.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.004 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 92.2 m -61.0 -46.11 92.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.0 mtpp -59.89 -47.87 84.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.853 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 180' ' ' ILE . 64.7 mt -60.23 -35.77 64.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.962 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 178' ' ' ASP . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 181' ' ' ARG . 30.4 t70 -57.72 -49.41 76.63 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.404 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 42.3 mm -60.65 -39.29 81.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.4 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.777 HD12 ' HA ' ' A' ' 177' ' ' ILE . 66.2 mt -56.39 -53.67 37.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.603 HH11 HG22 ' A' ' 177' ' ' ILE . 78.3 mtm-85 -52.38 -39.38 60.74 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.487 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 64.9 mtt -57.87 -40.2 79.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.434 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -70.37 -41.74 72.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.222 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 1.017 HD22 HD23 ' A' ' 131' ' ' LEU . 4.4 mm? -61.11 -51.71 67.94 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.504 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 16.9 ptm180 -59.29 -45.09 92.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.422 ' HA ' ' OE1' ' A' ' 189' ' ' GLN . 79.4 ttt180 -63.72 -35.75 81.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.098 0.475 . . . . 0.0 110.565 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -67.39 -38.79 85.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.324 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 89.3 mt -65.79 -51.67 57.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.897 -179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.422 ' OE1' ' HA ' ' A' ' 186' ' ' ARG . 2.7 pt20 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.894 0.378 . . . . 0.0 111.666 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.13 -40.9 82.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -60.82 -39.14 87.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.799 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 188' ' ' LEU . 90.2 mt-30 -54.84 -41.96 71.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.469 ' O ' HD13 ' A' ' 193' ' ' LEU . 2.2 tm? -62.67 -49.77 73.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.179 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -74.02 -147.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.78 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -177.87 127.22 0.13 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.858 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -76.89 132.02 38.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.886 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -67.17 131.33 45.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.066 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 63.7 137.11 0.04 OUTLIER Pre-proline 0 CA--C 1.529 0.161 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.518 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo . . . . . 0 C--O 1.249 1.054 0 C-N-CA 122.45 2.1 . . . . 0.0 112.229 179.839 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.14 125.48 83.94 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 120.506 0.193 . . . . 0.0 111.05 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.717 ' HG2' HG23 ' A' ' 123' ' ' THR . 80.2 Cg_endo -79.43 42.98 1.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.566 2.177 . . . . 0.0 112.548 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.825 ' HB1' HD11 ' A' ' 125' ' ' LEU . . . 59.38 41.81 19.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.783 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.717 HG23 ' HG2' ' A' ' 121' ' ' PRO . 53.8 p -87.49 -45.25 10.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.156 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.436 ' HA ' ' NH2' ' A' ' 127' ' ' ARG . 5.0 m120 -78.52 49.56 0.88 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.407 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.825 HD11 ' HB1' ' A' ' 122' ' ' ALA . 88.1 mt -93.09 -46.31 7.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.7 0.286 . . . . 0.0 111.619 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.5 m -66.77 -49.79 64.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.436 ' NH2' ' HA ' ' A' ' 124' ' ' ASN . 62.2 mtm-85 -61.14 -48.0 83.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.46 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 96.2 t -65.34 -48.82 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.294 . . . . 0.0 111.773 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.6 83.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.325 -179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.58 -46.03 95.12 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.535 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 184' ' ' LEU . 82.8 mt -65.61 -43.67 88.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.828 0.347 . . . . 0.0 111.093 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -60.64 -50.84 71.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.867 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 22.1 ptmt -57.93 -38.82 76.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.559 0.218 . . . . 0.0 110.907 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.0 mm-40 -57.92 -45.33 86.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.803 0.335 . . . . 0.0 110.66 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.519 ' HA ' ' CD ' ' A' ' 138' ' ' GLU . 60.5 tp -60.27 -38.34 83.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.271 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.6 80.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.07 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.8 mt -64.57 -49.09 82.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.677 ' OE1' HG13 ' A' ' 180' ' ' ILE . 7.6 pt-20 -57.89 -44.8 86.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.1 mt -59.89 -42.17 93.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.752 0.311 . . . . 0.0 110.943 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -59.39 -45.26 91.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.02 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.3 t -65.86 -45.94 90.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.667 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 40.2 ttmt -60.16 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.679 0.276 . . . . 0.0 111.107 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.31 -43.4 98.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.856 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.2 -37.86 94.68 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.335 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.37 -42.88 82.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 110.417 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.48 -41.22 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.736 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 46.4 m-20 -58.07 -45.66 86.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.613 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 92.0 mmm -65.6 -46.04 80.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 145' ' ' ALA . 87.4 mt -55.79 -46.24 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.181 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 72.9 mt-30 -62.16 -41.2 98.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.0 m -64.79 -37.74 88.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.584 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -75.25 -34.39 61.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.109 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 89.2 p -60.31 -48.23 82.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -65.04 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -67.75 -55.83 13.15 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.487 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.5 t -59.43 123.63 17.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.775 0.288 . . . . 0.0 110.523 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 91.0 m 63.11 140.17 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.921 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -166.14 36.53 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 111.461 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.6 ' OD1' ' HB3' ' A' ' 162' ' ' LEU . 1.3 p30 -68.79 130.83 43.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.549 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.618 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 41.3 mmm-85 -74.52 -55.72 5.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.617 ' NZ ' ' HB2' ' A' ' 161' ' ' LYS . 0.0 OUTLIER -59.74 -50.94 71.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.599 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.6 ' HB3' ' OD1' ' A' ' 159' ' ' ASP . 60.7 tp -59.8 -43.41 94.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.494 0.188 . . . . 0.0 111.104 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 61.3 tp -59.11 -40.4 85.23 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 160' ' ' ARG . 93.9 mt -54.79 -42.71 72.11 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.065 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 93.2 m -57.42 -46.02 83.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.262 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.15 94.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.797 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 30.1 mm100 -57.27 -47.27 81.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.407 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.42 -38.33 89.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.021 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 69.0 mmm -59.92 -46.52 89.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.284 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.509 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -56.48 -46.97 80.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.539 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -62.88 -42.64 99.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.917 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 48.7 m -58.22 -43.94 87.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.113 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.672 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 7.5 mtpm? -59.2 -44.22 92.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.739 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 179' ' ' ILE . 87.9 m -57.49 -43.53 84.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.574 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 7.9 mtpm? -56.99 -49.68 75.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.722 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.589 HD12 ' NZ ' ' A' ' 142' ' ' LYS . 56.4 mt -57.9 -41.08 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.184 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.09 -45.96 89.52 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.889 0.376 . . . . 0.0 110.586 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 175' ' ' THR . 51.2 mm -58.53 -39.68 76.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.384 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.677 HG13 ' OE1' ' A' ' 138' ' ' GLU . 46.9 mm -60.68 -47.32 93.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.855 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.0 tpt85 -52.9 -42.13 65.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.186 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -60.93 -42.32 97.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.554 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -61.1 -46.11 91.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.614 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -57.84 -42.27 84.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.868 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 51.2 mtp85 -59.9 -46.37 89.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.879 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 47.6 mtp85 -60.93 -37.76 83.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.083 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.68 -48.23 80.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.95 -43.98 97.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.2 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.7 mt-30 -62.16 -42.04 98.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.375 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.88 83.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.608 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.07 -47.15 81.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.753 0.311 . . . . 0.0 110.587 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -66.23 134.14 52.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 1.7 tt 59.55 50.19 7.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 109.823 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -70.03 -44.91 68.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.171 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -58.9 128.72 38.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.957 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -72.64 135.29 45.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.865 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.33 133.26 53.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.039 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -173.07 137.3 0.77 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 122.582 2.188 . . . . 0.0 112.269 -179.894 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.506 HG12 ' H ' ' A' ' 122' ' ' ALA . 12.1 tt -173.54 133.46 0.61 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.67 0.271 . . . . 0.0 110.961 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.452 ' HD2' HG13 ' A' ' 120' ' ' ILE . 21.0 Cg_endo -60.9 -34.18 91.47 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.772 2.315 . . . . 0.0 112.657 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.506 ' H ' HG12 ' A' ' 120' ' ' ILE . . . -52.58 -50.43 63.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.711 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 124' ' ' ASN . 81.0 p -74.07 -145.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.247 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 123' ' ' THR . 50.1 t30 73.81 -44.37 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.67 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.29 -39.9 92.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 51.0 m -56.81 -43.38 80.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.906 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -65.14 -44.61 88.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 82.7 t -61.03 -57.15 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.6 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.73 90.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.562 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.837 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.16 -47.67 89.84 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.909 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.56 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 82.8 mt -67.51 -41.34 84.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.666 0.27 . . . . 0.0 111.535 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -61.76 -47.65 84.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.776 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.837 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.8 pttt -60.08 -42.35 94.43 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.81 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HB3' HD13 ' A' ' 180' ' ' ILE . 30.4 mm100 -61.04 -40.5 93.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.816 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.522 ' C ' HD13 ' A' ' 135' ' ' LEU . 3.4 tm? -58.62 -46.42 87.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.248 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ALA . . . . . 0.506 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -66.79 -45.95 76.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.07 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.559 ' O ' HG23 ' A' ' 141' ' ' VAL . 71.2 mt -60.96 -48.62 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.65 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.3 pt-20 -59.78 -43.82 94.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.585 HD23 HD13 ' A' ' 177' ' ' ILE . 84.0 mt -59.29 -45.16 92.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.684 0.278 . . . . 0.0 110.984 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.602 ' HB3' ' NZ ' ' A' ' 140' ' ' LYS . 8.1 mtpm? -59.73 -42.91 94.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.933 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.6 t -62.41 -40.55 88.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.734 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.3 tttt -61.35 -49.04 78.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.97 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -61.43 -44.39 97.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.536 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.17 -38.42 95.58 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.638 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.51 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.47 -41.51 84.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.976 0.417 . . . . 0.0 110.765 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 96.2 mt-10 -59.53 -44.14 93.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.021 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -60.85 -44.42 97.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.547 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.536 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 91.9 mmm -64.3 -42.7 96.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.238 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.561 HD11 ' HA ' ' A' ' 167' ' ' GLN . 88.8 mt -62.63 -47.78 91.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 84.6 mt-30 -63.52 -44.94 92.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.182 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 94.5 m -62.5 -49.43 75.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.68 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.505 ' HA ' ' CG2' ' A' ' 157' ' ' THR . 2.7 m-30 -64.29 -43.86 93.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.691 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 61.0 m -78.41 48.71 0.79 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.297 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.448 ' CG ' ' H ' ' A' ' 155' ' ' GLY . 9.5 t-20 -166.14 -138.59 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 121.104 -0.238 . . . . 0.0 111.137 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLY . . . . . 0.448 ' H ' ' CG ' ' A' ' 154' ' ' ASN . . . -89.13 160.0 29.24 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.142 -0.551 . . . . 0.0 113.719 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 37.7 t 63.85 24.99 13.92 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 122.685 0.394 . . . . 0.0 111.673 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.505 ' CG2' ' HA ' ' A' ' 152' ' ' TYR . 28.3 m -170.34 147.14 3.0 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.689 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -156.93 22.26 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 111.124 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -75.74 90.92 2.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.505 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 48.1 mmt-85 -65.18 -45.24 85.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.481 -179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 22.0 pttp -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.77 0.319 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.416 ' N ' ' HG3' ' A' ' 161' ' ' LYS . 90.7 mt -64.53 -37.68 88.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.368 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 62.8 tp -58.51 -42.66 88.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.43 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.498 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 85.1 mt -63.05 -38.73 92.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.402 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.0 m -65.43 -41.74 93.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.888 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.91 -48.63 70.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.597 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.561 ' HA ' HD11 ' A' ' 149' ' ' ILE . 3.2 pt20 -58.24 -38.57 77.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.077 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -63.09 -39.98 96.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.827 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 68.5 mtp -61.58 -46.33 90.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.813 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.513 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 56.2 tp -57.02 -46.1 82.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.286 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -60.87 -46.8 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.22 -42.42 98.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.6 m -62.86 -49.74 73.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.429 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.9 mtpp -57.14 -43.24 82.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.011 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.1 m -59.01 -47.42 85.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.94 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.3 -40.21 81.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.585 HD13 HD23 ' A' ' 139' ' ' LEU . 53.0 mt -59.74 -39.78 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -62.47 -53.13 59.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.279 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -62.48 -56.15 19.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.084 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.65 HD12 ' OE1' ' A' ' 138' ' ' GLU . 68.0 mt -52.7 -40.24 33.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.627 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.587 ' HD3' HD12 ' A' ' 184' ' ' LEU . 15.6 tpp85 -54.77 -43.95 73.23 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.984 0.421 . . . . 0.0 110.081 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 91.2 mmm -57.32 -43.7 83.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.458 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -67.32 -32.27 73.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.276 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.587 HD12 ' HD3' ' A' ' 181' ' ' ARG . 20.7 mt -57.09 -57.13 13.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.252 0.549 . . . . 0.0 110.663 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 14.7 ptp180 -62.6 -41.57 99.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.182 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.549 ' HD2' ' O ' ' A' ' 186' ' ' ARG . 4.7 tmm_? -59.22 -40.27 85.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -67.47 -45.87 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.565 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.519 ' HA ' ' OD2' ' A' ' 191' ' ' ASP . 79.7 mt -60.25 -48.14 83.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.972 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 15.6 pt20 -62.1 -45.06 95.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.942 0.401 . . . . 0.0 111.419 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -61.68 -52.07 65.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.193 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 191' ' ' ASP . . . . . 0.519 ' OD2' ' HA ' ' A' ' 188' ' ' LEU . 3.0 p30 -61.79 -27.95 69.11 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.896 0.379 . . . . 0.0 110.413 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -76.68 54.08 0.94 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.607 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 193' ' ' LEU . 2.9 tm? -164.16 -43.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.074 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 58.59 -126.63 1.44 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -155.28 -40.27 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.806 0.336 . . . . 0.0 110.537 -179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -57.3 136.3 56.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.859 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.14 135.05 57.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.305 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -64.04 137.57 97.15 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.191 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 C--O 1.249 1.033 0 C-N-CA 122.556 2.17 . . . . 0.0 112.207 -179.974 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.484 -0.247 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.545 ' N ' HD12 ' A' ' 120' ' ' ILE . 2.6 mp -65.18 131.75 95.16 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.565 0.222 . . . . 0.0 110.74 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 22.7 Cg_exo -65.41 -148.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.684 2.256 . . . . 0.0 112.724 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.12 64.59 5.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.572 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.9 t -158.58 140.07 13.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 111.356 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.6 m120 60.76 37.91 18.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.042 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.49 -47.15 12.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 52.5 m -63.24 -33.45 75.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.338 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.576 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 5.5 tpm_? -58.35 -49.79 75.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.475 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.2 t -65.49 -51.51 62.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.51 93.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.921 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.79 -49.67 66.7 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.827 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 184' ' ' LEU . 98.1 mt -65.74 -44.85 84.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.831 0.348 . . . . 0.0 111.083 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -56.81 -50.8 71.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.627 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 15.0 ptmm? -58.71 -36.63 74.56 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.414 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.715 ' HB3' HD13 ' A' ' 180' ' ' ILE . 48.1 mm-40 -56.2 -45.22 79.9 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.509 179.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 4.5 mm? -58.74 -41.18 85.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.065 0.46 . . . . 0.0 110.485 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.1 89.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.935 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.7 mt -66.46 -49.53 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.127 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.494 ' OE2' ' HG ' ' A' ' 139' ' ' LEU . 1.4 pp20? -60.19 -43.32 96.0 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.464 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.494 ' HG ' ' OE2' ' A' ' 138' ' ' GLU . 93.1 mt -56.54 -45.31 81.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.82 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -62.39 -47.06 85.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 137' ' ' ILE . 61.5 t -64.93 -40.83 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.424 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.488 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 61.8 tttm -62.21 -50.21 72.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.173 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 66.3 tt0 -64.01 -44.89 91.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.763 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.455 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -63.15 -34.78 90.89 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.534 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.07 -42.48 80.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.952 0.406 . . . . 0.0 110.799 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.4 mt-10 -60.7 -43.59 97.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -60.99 -41.36 96.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.455 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.2 mtp -64.66 -44.3 90.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 79.9 mt -58.64 -50.29 79.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.544 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -65.48 -39.97 92.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.502 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.8 m -57.4 -49.33 76.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.779 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.97 ' HB2' HD13 ' A' ' 163' ' ' LEU . 4.2 m-85 -72.3 -43.12 64.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.708 0.29 . . . . 0.0 111.355 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 69.9 m -54.38 139.13 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.106 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 5.3 m120 66.12 135.67 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.095 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 79.39 -35.99 2.0 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.895 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' SER . . . . . 0.621 ' HB2' HH21 ' A' ' 160' ' ' ARG . 43.7 t 61.83 49.08 4.98 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.005 0.431 . . . . 0.0 110.793 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 62.3 m -57.72 -35.12 70.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.337 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' A' ' 159' ' ' ASP . 53.9 tptt -130.48 170.35 14.34 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.669 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.474 ' N ' ' HG3' ' A' ' 158' ' ' LYS . 31.2 m-20 -54.25 136.98 42.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.09 0.471 . . . . 0.0 111.537 -179.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.621 HH21 ' HB2' ' A' ' 156' ' ' SER . 21.7 mmt85 -64.61 -32.78 74.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.487 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.429 ' HG2' ' HB3' ' A' ' 159' ' ' ASP . 8.5 ptpp? -53.06 -45.25 68.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.037 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.456 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 98.2 mt -62.91 -38.3 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.255 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.97 HD13 ' HB2' ' A' ' 152' ' ' TYR . 54.5 tp -58.12 -43.4 87.18 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.51 -42.49 92.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.529 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.7 m -59.06 -43.04 91.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.944 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.01 -44.16 97.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -57.74 -43.23 85.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.398 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -60.51 -38.02 83.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.048 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.6 mtp -62.11 -47.22 85.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.848 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.515 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -57.8 -48.55 79.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.006 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 14.8 tm0? -62.43 -43.53 98.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.013 -179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.558 ' OD1' ' HE2' ' A' ' 176' ' ' LYS . 8.7 t70 -61.29 -43.58 98.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.092 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 177' ' ' ILE . 38.8 t -59.72 -46.17 89.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -57.93 -40.31 80.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.901 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 88.7 m -58.62 -45.93 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.558 ' HE2' ' OD1' ' A' ' 172' ' ' ASP . 68.0 mttm -61.07 -43.81 98.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 173' ' ' SER . 63.0 mt -55.61 -40.87 61.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.355 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -64.97 -48.62 73.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.073 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 43.4 mm -61.73 -47.19 94.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.715 HD13 ' HB3' ' A' ' 134' ' ' GLN . 74.8 mt -61.82 -40.58 87.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.001 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 181' ' ' ARG . 41.5 ttt85 -55.18 -44.75 75.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 43.9 tpp -61.23 -39.98 92.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.154 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 35.0 mt-30 -59.66 -41.01 89.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.709 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.491 HD23 HD13 ' A' ' 131' ' ' LEU . 8.2 mt -59.31 -43.99 92.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.226 0.536 . . . . 0.0 109.954 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.621 ' HA ' HH11 ' A' ' 185' ' ' ARG . 3.3 mmm180 -56.6 -41.87 77.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.218 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.95 -39.39 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.716 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.65 -44.96 95.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.018 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.02 -41.72 99.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.731 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.0 mt-30 -64.51 -36.19 83.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.82 59.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.554 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -72.25 -60.04 2.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.011 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -74.44 134.15 42.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.964 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 62.8 tp -172.48 128.28 0.54 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.918 0.389 . . . . 0.0 111.042 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -72.88 -134.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.858 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -171.1 135.88 1.03 Allowed 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.656 0.265 . . . . 0.0 110.416 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 54.2 tt0 -138.76 135.16 34.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.024 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.1 138.2 58.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.24 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . -59.45 140.2 88.61 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.046 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 48.1 Cg_exo . . . . . 0 C--O 1.248 1.014 0 C-N-CA 122.577 2.185 . . . . 0.0 112.367 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.575 -0.21 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.561 HD12 ' HD2' ' A' ' 121' ' ' PRO . 7.1 tp -171.89 125.52 0.55 Allowed Pre-proline 0 CA--C 1.532 0.285 0 CA-C-O 120.564 0.221 . . . . 0.0 110.923 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.561 ' HD2' HD12 ' A' ' 120' ' ' ILE . 2.9 Cg_exo -76.01 49.32 2.49 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.038 2.492 . . . . 0.0 112.742 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -163.39 -151.88 0.19 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.067 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 124' ' ' ASN . 74.6 p -84.88 -65.64 0.99 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.665 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 123' ' ' THR . 17.8 t-20 178.45 46.32 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.35 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 126' ' ' SER . 4.0 pp -75.54 -26.23 57.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.393 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.675 ' N ' HD12 ' A' ' 125' ' ' LEU . 55.9 m -54.8 -49.53 70.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.827 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.551 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 4.0 mmp_? -62.33 -45.47 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.707 0.289 . . . . 0.0 111.537 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 59.8 t -58.64 -46.21 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.61 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.72 92.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.702 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.746 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -65.62 -44.98 91.68 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.117 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 184' ' ' LEU . 92.4 mt -65.61 -43.22 90.3 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.744 -0.268 . . . . 0.0 111.474 -179.378 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.8 mm-40 -64.39 -46.61 82.58 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.746 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 66.0 pttt -57.83 -41.12 81.65 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.771 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 13.2 mm100 -59.46 -43.27 93.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.692 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.3 tm? -60.43 -43.82 96.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.88 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.3 84.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.485 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.1 -40.93 76.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.615 ' HB3' HD11 ' A' ' 177' ' ' ILE . 63.2 mm-40 -61.67 -42.1 98.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.0 mt -59.16 -42.83 91.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.292 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.07 -47.75 83.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.732 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.7 t -71.28 -48.77 52.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -60.88 -52.21 66.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.5 -179.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.21 -46.44 88.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.832 0.349 . . . . 0.0 110.752 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.518 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -62.34 -34.84 90.52 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.149 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.89 -40.3 91.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.937 0.399 . . . . 0.0 110.211 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -59.84 -42.08 92.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.32 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -59.99 -42.12 93.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.201 179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 89.1 mmm -64.46 -42.66 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.63 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.3 mt -60.69 -50.46 80.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.472 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -66.13 -42.52 89.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.761 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -49.53 77.21 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.919 ' HB2' HD13 ' A' ' 163' ' ' LEU . 2.2 m-85 -73.54 -51.33 17.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.717 0.294 . . . . 0.0 111.706 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.5 t -64.93 134.55 54.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.981 0.419 . . . . 0.0 111.747 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 35.2 m-20 55.8 45.59 23.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.531 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 169.42 132.03 1.39 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.87 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 52.8 m -62.25 142.22 57.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.529 0.204 . . . . 0.0 110.46 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 86.7 m -155.54 -53.51 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.391 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.53 ' HG2' ' H ' ' A' ' 159' ' ' ASP . 20.8 ttmm -176.01 -132.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.858 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.53 ' H ' ' HG2' ' A' ' 158' ' ' LYS . 57.8 m-20 -71.23 137.71 48.87 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 111.856 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.564 ' HE ' HD23 ' A' ' 163' ' ' LEU . 12.0 tpt180 -71.78 -37.09 70.49 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.543 179.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -53.31 -41.72 65.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.609 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.562 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 97.2 mt -58.4 -39.02 78.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.437 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.919 HD13 ' HB2' ' A' ' 152' ' ' TYR . 30.8 tp -57.78 -46.86 83.98 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.068 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 93.2 mt -58.77 -41.72 87.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.938 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 86.8 m -61.12 -41.32 96.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.519 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.29 80.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.445 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -60.41 -45.47 93.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.133 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -62.5 -40.78 97.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.538 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.6 mmm -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.585 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 2.9 tm? -61.48 -44.32 97.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -57.3 -47.17 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.288 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 63.6 t0 -66.38 -40.95 90.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.191 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.5 m -62.12 -52.41 63.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.914 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.597 ' NZ ' ' HB2' ' A' ' 174' ' ' LYS . 0.0 OUTLIER -61.83 -41.65 98.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.506 -179.466 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 93.4 m -57.84 -48.53 79.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.795 0.331 . . . . 0.0 111.255 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.559 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 4.0 mmmp? -58.98 -40.25 84.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.615 HD11 ' HB3' ' A' ' 138' ' ' GLU . 40.0 mt -59.91 -38.63 77.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 181' ' ' ARG . 58.2 m-20 -60.86 -45.04 96.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 110.009 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 56.9 mt -59.59 -49.05 85.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.361 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.525 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -62.18 -36.42 74.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.606 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 185' ' ' ARG . 51.2 ttt-85 -52.39 -50.29 62.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.543 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 62.0 mtm -63.54 -38.75 92.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.871 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 80.9 mt-30 -56.72 -46.42 81.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.747 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -61.92 -42.12 98.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.002 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 3.7 mmp_? -52.42 -48.27 65.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.21 -35.32 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.459 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.11 89.06 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.789 0.328 . . . . 0.0 111.171 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.437 HD13 ' O ' ' A' ' 184' ' ' LEU . 9.9 mp -67.58 -41.88 83.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.193 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 94.8 mm-40 -56.58 -45.54 81.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.802 0.334 . . . . 0.0 111.021 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -36.9 70.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.285 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -57.27 -49.79 74.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.669 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -65.36 127.54 32.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.825 0.345 . . . . 0.0 111.047 -179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 41.6 tp 179.56 59.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.515 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -161.75 -37.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.404 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -53.9 -47.45 71.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.984 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -72.02 129.95 39.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.807 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -69.99 134.07 47.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.045 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.571 ' N ' ' HD2' ' A' ' 199' ' ' PRO . . . -63.9 -50.44 70.18 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.633 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 198' ' ' ALA . 35.8 Cg_endo . . . . . 0 C--O 1.249 1.055 0 C-N-CA 122.136 1.89 . . . . 0.0 112.333 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 112.576 -0.209 . . . . 0.0 112.576 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.665 HD12 ' HD2' ' A' ' 121' ' ' PRO . 7.8 tp -176.29 128.05 0.35 Allowed Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.551 0.215 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.665 ' HD2' HD12 ' A' ' 120' ' ' ILE . 40.7 Cg_exo -57.47 -49.24 14.18 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.391 2.061 . . . . 0.0 112.409 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.15 -95.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.293 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.9 t 42.46 48.78 4.59 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.159 0.504 . . . . 0.0 111.661 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -165.05 -37.58 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.567 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 99.2 mt -57.01 -38.69 73.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.075 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.2 t -56.0 -45.67 78.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.773 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 127' ' ' ARG . 54.2 ttp85 -64.96 -42.77 94.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.759 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.25 -48.25 85.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.579 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -61.5 -45.64 93.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.701 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.588 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -57.98 -48.73 80.69 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.989 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 184' ' ' LEU . 64.4 mt -68.34 -43.43 77.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.015 0.436 . . . . 0.0 111.05 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.75 -46.53 89.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 16.9 ptpt -61.71 -40.37 94.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.978 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -56.21 -45.83 79.72 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.8 0.333 . . . . 0.0 110.761 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 97.2 mt -58.91 -45.93 89.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.315 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.4 -47.76 80.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 133' ' ' LYS . 76.4 mt -56.56 -43.34 78.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.437 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.0 mm-40 -61.87 -41.79 98.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.158 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.2 mt -57.91 -39.95 79.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.859 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -62.69 -48.99 76.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.035 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 51.1 t -65.5 -42.49 93.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -59.69 -46.41 89.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.669 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -61.72 -47.23 86.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.417 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.97 -36.41 90.16 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.606 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.632 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -66.57 -41.52 88.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 110.501 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.675 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 33.3 m120 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.654 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.483 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.0 mtp -70.57 -48.93 52.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.222 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.2 mt -53.83 -47.29 63.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.361 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -66.69 -38.17 86.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.316 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.615 ' O ' HG21 ' A' ' 157' ' ' THR . 55.6 m -61.56 -51.37 68.84 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.654 ' HB2' HD13 ' A' ' 163' ' ' LEU . 18.4 m-85 -74.82 -51.25 14.5 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' SER . . . . . 0.407 ' O ' ' HB3' ' A' ' 154' ' ' ASN . 47.4 t -68.43 115.32 7.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.79 0.329 . . . . 0.0 111.622 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 153' ' ' SER . 24.1 p30 172.55 -35.22 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.516 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -167.48 -48.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.755 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 48.1 t -174.97 -50.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.76 0.28 . . . . 0.0 111.412 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.615 HG21 ' O ' ' A' ' 151' ' ' THR . 71.4 p 49.02 -145.77 0.38 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.9 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.66 ' HG3' ' H ' ' A' ' 159' ' ' ASP . 19.2 tptm -72.17 -143.25 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.66 ' H ' ' HG3' ' A' ' 158' ' ' LYS . 1.5 m-20 -72.78 127.55 32.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.519 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 34.0 ttm180 -72.17 -15.65 61.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.1 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.583 ' HG2' ' HB3' ' A' ' 159' ' ' ASP . 14.6 ptmm? -53.37 -40.86 65.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.01 0.433 . . . . 0.0 110.11 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.11 -31.56 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.365 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.654 HD13 ' HB2' ' A' ' 152' ' ' TYR . 51.2 tp -57.91 -48.78 78.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.635 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.92 -44.84 91.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.821 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.1 m -60.96 -41.21 95.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.01 95.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.902 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.46 ' HA ' HD11 ' A' ' 149' ' ' ILE . 36.3 mt-30 -59.45 -40.04 85.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.101 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -61.03 -39.39 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.357 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 67.2 mtp -66.16 -45.63 80.25 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.086 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 145' ' ' ALA . 2.9 tm? -57.38 -52.18 66.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.256 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -64.18 -40.94 97.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.375 -179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -61.79 -44.13 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.898 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 177' ' ' ILE . 47.6 t -59.11 -45.57 90.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.046 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.69 -41.98 87.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.907 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.0 m -56.24 -47.13 79.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.969 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.524 ' O ' HG13 ' A' ' 180' ' ' ILE . 63.7 mttp -61.43 -39.8 92.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.576 ' O ' ' HG2' ' A' ' 181' ' ' ARG . 57.7 mt -62.72 -41.58 92.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.415 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -60.57 -51.44 69.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.368 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.445 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 34.1 pt -63.07 -40.02 87.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.512 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.56 HD13 ' HB3' ' A' ' 134' ' ' GLN . 62.4 mt -60.22 -45.34 96.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.59 0.233 . . . . 0.0 110.824 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 26.1 mmm180 -56.2 -44.13 79.17 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.324 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.762 ' HG3' HH21 ' A' ' 185' ' ' ARG . 45.8 ttm -59.36 -40.23 85.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.412 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 99.3 mm-40 -60.75 -38.28 84.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.269 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.749 HD22 HD13 ' A' ' 131' ' ' LEU . 8.3 mt -60.34 -43.67 96.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.227 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.762 HH21 ' HG3' ' A' ' 182' ' ' MET . 72.6 mtm180 -56.8 -46.3 81.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.176 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -65.29 -38.87 91.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.59 83.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.949 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 25.5 tp -67.76 -40.62 84.06 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.126 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' ' 193' ' ' LEU . 98.2 mm-40 -57.77 -45.06 86.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.129 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.66 -40.67 92.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.336 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.26 -50.3 72.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.394 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -62.27 -34.39 76.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.18 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 189' ' ' GLN . 95.2 mt -76.94 46.46 0.47 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.185 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 194' ' ' GLU . 37.8 tt0 -172.65 42.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.184 0.516 . . . . 0.0 110.089 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -63.37 144.03 57.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.021 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 48.9 mm-40 -55.76 138.58 47.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.807 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -55.81 134.34 51.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.166 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.509 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -171.03 57.27 0.26 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.092 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 39.6 Cg_exo . . . . . 0 C--O 1.249 1.065 0 C-N-CA 122.479 2.119 . . . . 0.0 112.28 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.713 HD12 HG22 ' A' ' 128' ' ' VAL . 68.7 mt -60.16 131.74 89.87 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.562 0.22 . . . . 0.0 110.962 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.61 -40.95 60.71 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.595 2.197 . . . . 0.0 112.413 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 123' ' ' THR . . . -169.56 -110.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.006 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.454 ' HB ' ' O ' ' A' ' 122' ' ' ALA . 85.0 m 75.89 -40.39 0.4 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.24 0.337 . . . . 0.0 111.764 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.471 ' OD1' ' HB3' ' A' ' 126' ' ' SER . 25.8 t-20 -169.31 -41.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 121.312 -0.155 . . . . 0.0 111.234 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 124' ' ' ASN . 93.8 mt 75.11 -50.65 0.66 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.595 0.559 . . . . 0.0 111.513 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.471 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 47.3 t -60.07 -38.88 84.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.853 0.359 . . . . 0.0 110.56 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.506 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 29.7 tpt180 -60.76 -42.61 97.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.639 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.713 HG22 HD12 ' A' ' 120' ' ' ILE . 92.1 t -57.46 -53.3 45.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.347 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.83 -36.74 84.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -59.89 -43.8 97.71 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.341 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.535 ' HB3' HD11 ' A' ' 184' ' ' LEU . 77.5 mt -67.1 -41.6 86.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.89 0.376 . . . . 0.0 110.807 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -63.18 -49.63 73.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.591 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.441 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.36 -41.49 89.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.585 0.231 . . . . 0.0 110.922 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.1 mm-40 -58.61 -41.32 85.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 135' ' ' LEU . 1.7 tm? -59.95 -43.97 94.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.641 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.84 71.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.968 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 133' ' ' LYS . 70.9 mt -58.5 -46.54 89.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.542 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' HB3' ' A' ' 176' ' ' LYS . 96.0 mt-10 -59.62 -45.32 92.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.79 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 70.6 mt -62.16 -33.57 74.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.341 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -58.67 -48.46 81.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.702 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.4 t -71.4 -42.21 73.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.17 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.665 ' HZ3' ' HD3' ' A' ' 174' ' ' LYS . 39.5 ttmt -58.67 -50.15 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -62.34 -42.98 99.83 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.649 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.24 -38.01 93.87 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.104 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.21 -40.94 86.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.97 0.414 . . . . 0.0 110.375 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.9 mt-10 -59.09 -44.6 91.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.268 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.2 t-20 -60.96 -39.84 91.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.798 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.0 mtp -64.57 -37.21 86.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.693 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 72.4 mt -64.62 -45.84 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.817 0.342 . . . . 0.0 111.042 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.61 -42.28 74.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.352 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.403 ' C ' ' H ' ' A' ' 153' ' ' SER . 88.8 m -68.13 -48.54 65.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.656 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.655 ' HA ' ' HB ' ' A' ' 157' ' ' THR . 1.3 m-85 -75.31 21.4 0.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.67 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 151' ' ' THR . 65.1 m -75.95 -44.33 40.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.882 0.372 . . . . 0.0 110.715 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -172.46 -44.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -63.22 132.24 42.31 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.264 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.5 t 65.93 -74.64 0.06 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 122.407 0.283 . . . . 0.0 111.126 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.655 ' HB ' ' HA ' ' A' ' 152' ' ' TYR . 90.6 m -64.0 146.47 54.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.783 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -131.5 -37.91 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.425 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -57.77 123.78 16.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.441 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 48.3 mmt-85 -74.09 -38.36 63.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.153 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -53.21 -44.48 68.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.144 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.448 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 91.8 mt -61.35 -39.89 92.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.556 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 152' ' ' TYR . 65.5 tp -58.66 -45.59 89.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.649 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.1 mt -59.45 -40.65 87.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.57 179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -57.57 -42.95 84.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.753 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -60.43 -41.96 95.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.1 mt-30 -57.54 -43.06 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.319 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -60.34 -40.57 91.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.126 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.523 ' HA ' ' OD2' ' A' ' 172' ' ' ASP . 0.0 OUTLIER -60.74 -36.61 79.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.847 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.8 tm? -69.2 -45.81 68.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.707 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -64.76 -45.96 84.15 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 169' ' ' MET . 3.0 p30 -64.42 -37.73 88.55 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.07 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.407 ' HB2' ' HB2' ' A' ' 142' ' ' LYS . 90.3 p -62.76 -44.04 97.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.665 ' HD3' ' HZ3' ' A' ' 142' ' ' LYS . 74.9 mmtt -54.84 -48.15 73.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.307 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.1 m -56.06 -43.44 77.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.959 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.465 ' HB3' ' CD ' ' A' ' 138' ' ' GLU . 63.3 mttp -53.37 -46.89 69.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.052 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.521 HD13 ' HZ1' ' A' ' 142' ' ' LYS . 1.8 mp -58.16 -41.74 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.691 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 178' ' ' ASP . . . . . 0.415 ' HA ' ' HD2' ' A' ' 181' ' ' ARG . 1.2 m-20 -55.76 -44.37 77.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.194 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 1.7 mp -59.36 -46.34 92.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.163 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.683 ' O ' HD13 ' A' ' 184' ' ' LEU . 44.6 mt -57.81 -41.11 79.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.728 0.299 . . . . 0.0 110.889 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 98.4 mtt180 -55.04 -50.32 69.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.225 0.536 . . . . 0.0 110.82 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 25.1 ttm -67.49 -42.99 82.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.093 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 49.1 mm-40 -62.16 -47.8 82.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.82 0.343 . . . . 0.0 111.474 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 180' ' ' ILE . 6.5 mp -61.69 -47.86 83.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.51 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.519 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 44.8 mmm-85 -60.25 -46.4 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.72 0.295 . . . . 0.0 110.963 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.01 -39.83 91.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.038 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.47 -43.99 96.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.075 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 84.5 mt -65.82 -42.73 90.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.026 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 99.3 mm-40 -61.65 -43.09 99.51 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -59.92 -45.89 91.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.108 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.24 -42.85 99.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.729 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' A' ' 192' ' ' GLN . 32.3 tp60 -79.21 45.56 0.65 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.768 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 36.7 tp -175.58 52.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.355 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -165.74 144.51 6.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.076 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -165.02 -38.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -58.47 134.5 56.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.743 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.45 133.18 55.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.281 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -174.47 133.41 0.53 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.83 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo . . . . . 0 C--O 1.249 1.052 0 C-N-CA 122.457 2.105 . . . . 0.0 112.226 179.935 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.535 ' N ' HD12 ' A' ' 120' ' ' ILE . 2.3 mp -64.18 131.1 94.9 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.575 0.226 . . . . 0.0 110.827 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 3.2 Cg_exo -76.25 38.5 0.61 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.891 2.394 . . . . 0.0 112.497 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 55.87 50.79 13.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.787 0.327 . . . . 0.0 111.162 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.432 HG22 ' HD2' ' A' ' 121' ' ' PRO . 9.2 t -136.45 37.93 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.459 . . . . 0.0 111.128 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' ' 128' ' ' VAL . 33.1 m120 -157.78 -47.55 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.439 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.519 ' O ' HD13 ' A' ' 125' ' ' LEU . 3.1 tm? -62.14 -44.46 96.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.442 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.2 m -60.02 -44.47 94.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.056 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -60.41 -45.0 95.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.08 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 124' ' ' ASN . 57.3 t -61.84 -44.4 98.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.82 89.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.24 -43.13 98.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.518 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 184' ' ' LEU . 92.3 mt -67.52 -40.27 85.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.723 0.297 . . . . 0.0 111.196 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -64.44 -49.14 72.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.586 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.581 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -58.11 -41.38 83.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.876 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.03 -42.12 97.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.88 0.372 . . . . 0.0 110.76 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.503 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 67.0 tp -59.64 -45.51 91.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.102 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.68 -40.88 98.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.55 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.648 HG23 ' NZ ' ' A' ' 140' ' ' LYS . 81.8 mt -61.33 -50.14 81.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.876 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.652 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.8 pt-20 -65.86 -39.97 91.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.278 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.8 mt -58.87 -44.91 91.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 112.046 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.648 ' NZ ' HG23 ' A' ' 137' ' ' ILE . 23.5 pttm -65.68 -42.95 90.65 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.868 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.5 t -64.07 -43.51 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.967 0.413 . . . . 0.0 110.627 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.451 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttm -63.08 -43.27 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.626 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.65 -43.02 98.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.834 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.452 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.32 -38.95 96.54 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.698 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.452 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -69.01 -42.18 76.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.011 0.434 . . . . 0.0 110.95 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 55.5 mt-10 -61.72 -44.72 96.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.071 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -60.25 -44.18 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.086 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.8 mmm -64.06 -48.78 74.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.348 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.612 HD11 ' HA ' ' A' ' 167' ' ' GLN . 77.6 mt -59.69 -46.46 93.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.422 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -65.67 -41.14 92.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.443 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.6 m -58.31 -45.66 87.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.859 0.361 . . . . 0.0 110.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.556 ' HA ' ' HB ' ' A' ' 157' ' ' THR . 2.3 m-30 -66.22 -47.78 72.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.718 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 95.5 p -71.09 128.53 36.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.333 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 34.3 m-20 52.93 57.57 6.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.397 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -159.13 -143.45 3.67 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.808 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 78.8 p -110.66 49.48 0.86 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.832 0.348 . . . . 0.0 111.307 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.556 ' HB ' ' HA ' ' A' ' 152' ' ' TYR . 89.7 m -161.29 131.89 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.552 ' HD2' ' N ' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -129.27 29.6 5.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.907 -179.806 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -73.51 93.82 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.496 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.419 ' HG3' HH11 ' A' ' 160' ' ' ARG . 42.7 mmm-85 -65.55 -39.82 92.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.474 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -56.3 -56.63 18.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.952 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.78 -32.42 72.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.951 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 45.5 tp -54.86 -50.6 68.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.843 0.354 . . . . 0.0 110.236 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 168' ' ' GLN . 81.3 mt -64.35 -37.98 89.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.874 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 96.9 m -56.58 -48.43 77.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.106 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.26 88.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.874 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.612 ' HA ' HD11 ' A' ' 149' ' ' ILE . 88.2 mt-30 -56.79 -42.76 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.446 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 164' ' ' LEU . 89.0 mt-30 -61.34 -41.59 97.29 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.228 179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.63 -47.34 84.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.494 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 57.0 tp -58.63 -40.67 83.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.887 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -57.82 -48.0 81.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.903 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.47 -42.92 97.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.412 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 49.8 m -59.04 -45.91 89.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -54.67 -42.05 70.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.493 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -58.76 -40.97 85.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.515 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.414 ' O ' HG13 ' A' ' 180' ' ' ILE . 54.5 mtpt -58.62 -46.69 86.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.221 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 2.0 mp -58.82 -42.49 85.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.311 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 178' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.4 m-20 -57.56 -54.89 41.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.737 0.303 . . . . 0.0 111.754 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.429 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.38 -46.55 96.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.602 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.652 HD12 ' OE1' ' A' ' 138' ' ' GLU . 53.9 mt -57.65 -44.46 85.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.023 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.525 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 78.1 mtp180 -56.16 -39.35 72.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.2 mmt -59.13 -41.19 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.597 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -67.72 -44.68 77.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -61.21 -49.64 76.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.633 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.556 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 3.5 ptm85 -59.51 -44.42 93.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.137 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.529 ' HD3' ' OE1' ' A' ' 189' ' ' GLN . 21.2 mmt85 -62.83 -38.56 91.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.961 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.69 79.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.593 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 91.8 mt -66.03 -46.4 78.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.066 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.556 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 9.8 pt20 -62.58 -49.17 76.31 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.51 29.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -67.71 -59.77 3.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 110.979 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.438 ' HB3' ' O ' ' A' ' 188' ' ' LEU . 65.1 tt0 -84.12 133.96 34.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 36.7 mt -156.22 37.0 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.789 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 51.38 -143.22 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.07 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.49 ' OD1' ' HG3' ' A' ' 196' ' ' GLN . 20.1 p30 -174.87 -39.83 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.584 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 196' ' ' GLN . . . . . 0.49 ' HG3' ' OD1' ' A' ' 195' ' ' ASN . 86.5 mt-30 -68.49 137.21 54.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.773 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.73 134.97 57.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.999 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 65.41 133.25 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.415 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--O 1.249 1.03 0 C-N-CA 122.583 2.189 . . . . 0.0 112.373 179.914 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 75.3 mt 65.05 128.2 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.821 0.343 . . . . 0.0 111.331 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.61 138.63 35.54 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.559 2.173 . . . . 0.0 112.627 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 69.91 -65.84 0.3 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.015 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.4 m -61.13 125.62 24.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.679 0.276 . . . . 0.0 110.83 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 128' ' ' VAL . 44.3 t30 -179.12 -36.7 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.908 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 91.9 mt -54.15 -42.25 69.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.8 m -58.68 -44.99 90.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 79.4 ttt180 -64.08 -39.94 95.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.782 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 124' ' ' ASN . 79.2 t -58.94 -51.29 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.59 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.77 -39.44 93.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.294 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.605 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -59.2 -44.69 96.24 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.58 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 87.6 mt -65.39 -44.33 87.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.853 0.358 . . . . 0.0 111.143 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.73 -46.39 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.734 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 24.2 pttm -58.98 -38.48 79.23 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.662 0.268 . . . . 0.0 110.778 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 47.5 mm-40 -59.71 -46.49 88.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.787 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 62.2 tp -56.98 -44.85 83.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.568 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.86 -51.06 71.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.773 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.518 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.8 mt -60.97 -46.3 96.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.189 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.647 ' HB3' HG12 ' A' ' 177' ' ' ILE . 0.2 OUTLIER -57.39 -46.27 83.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.951 -179.779 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 94.2 mt -58.1 -42.66 86.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.662 0.268 . . . . 0.0 111.053 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.482 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 7.4 tmtm? -62.13 -45.88 91.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.492 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 137' ' ' ILE . 47.8 t -62.49 -44.49 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.205 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.89 -45.23 93.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.942 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -62.04 -39.54 92.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.695 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.3 -40.99 96.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.51 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.15 -42.77 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.981 0.419 . . . . 0.0 110.412 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 51.0 mt-10 -61.96 -40.4 95.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.673 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -58.68 -44.83 90.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.546 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.432 ' HB2' ' HE3' ' A' ' 148' ' ' MET . 69.5 mtm -66.35 -41.09 90.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.151 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.4 mt -62.8 -49.5 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.799 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 15.6 pt20 -64.13 -40.74 96.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.663 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.2 m -65.68 -42.91 90.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.472 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.72 21.91 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.1 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 73.8 m -75.67 -47.05 27.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.755 0.312 . . . . 0.0 110.584 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -174.13 125.92 0.35 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.878 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 152.62 -141.2 8.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.174 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 58.0 m -68.23 -51.8 41.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.146 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 75.7 p -77.86 134.84 37.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.708 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 158' ' ' LYS . 59.8 tttp -169.77 39.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.071 0.462 . . . . 0.0 111.047 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -71.56 121.29 18.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.054 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 22.3 tpp180 -72.48 -46.92 52.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -58.26 -49.74 76.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.89 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.9 tp -67.91 -33.48 74.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 69.1 tp -56.15 -47.46 78.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.423 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.0 -42.52 94.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.568 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -59.24 -41.57 89.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.954 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.17 97.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 85.6 mt-30 -58.79 -41.71 87.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.895 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -60.35 -40.27 90.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.036 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.8 mtp -61.82 -48.54 80.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.787 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.525 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -57.97 -45.79 86.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.811 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 171' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 30.9 mm100 -60.94 -41.0 95.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.164 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.56 -44.57 86.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.115 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.541 ' HA ' ' HG2' ' A' ' 176' ' ' LYS . 52.8 m -66.65 -47.2 73.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.858 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.639 ' HD3' ' N ' ' A' ' 175' ' ' THR . 0.0 OUTLIER -60.25 -35.64 75.95 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.826 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 175' ' ' THR . . . . . 0.639 ' N ' ' HD3' ' A' ' 174' ' ' LYS . 85.7 m -71.47 -45.55 62.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 173' ' ' SER . 19.3 ptpt -63.81 -38.49 91.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.803 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.647 HG12 ' HB3' ' A' ' 138' ' ' GLU . 85.3 mt -63.37 -43.99 98.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.951 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -57.15 -44.04 83.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.966 0.413 . . . . 0.0 110.212 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 175' ' ' THR . 47.6 mm -61.2 -43.79 97.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.497 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 72.2 mt -58.82 -48.9 84.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -51.03 -41.65 59.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.252 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 48.4 tpp -60.71 -38.76 86.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.221 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -64.02 -43.72 94.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.967 179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.471 ' O ' HD13 ' A' ' 188' ' ' LEU . 4.2 mm? -60.64 -54.57 43.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.497 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.487 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 16.3 ptm180 -60.08 -41.05 91.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.682 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.24 -36.28 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.214 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -63.43 -47.13 83.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.389 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.471 HD13 ' O ' ' A' ' 184' ' ' LEU . 9.8 mp -66.06 -44.09 85.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.492 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 98.9 mm-40 -62.25 -43.05 99.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.297 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.06 -51.22 68.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.732 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -64.04 -45.49 88.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.222 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -79.13 50.22 1.03 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.416 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.486 HD13 ' N ' ' A' ' 194' ' ' GLU . 2.2 tm? -167.01 123.81 1.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.219 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.486 ' N ' HD13 ' A' ' 193' ' ' LEU . 55.2 mp0 -81.59 134.64 35.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.214 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -58.23 -35.24 71.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.033 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' GLN . . . . . 0.417 ' O ' ' HD3' ' A' ' 199' ' ' PRO . 4.4 tp-100 -137.16 135.19 37.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.0 135.82 57.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.198 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 57.96 56.59 6.89 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.512 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.417 ' HD3' ' O ' ' A' ' 196' ' ' GLN . 37.5 Cg_endo . . . . . 0 C--O 1.249 1.026 0 C-N-CA 122.388 2.058 . . . . 0.0 112.198 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 122' ' ' ALA . 69.4 mt -66.26 131.9 94.38 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.522 0.201 . . . . 0.0 111.197 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.54 -31.93 88.1 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.534 2.156 . . . . 0.0 111.963 179.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.665 ' H ' HG22 ' A' ' 120' ' ' ILE . . . 64.7 34.47 9.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.371 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 68.6 m -91.97 84.84 5.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.565 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -166.17 -36.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.091 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.777 HD12 ' N ' ' A' ' 126' ' ' SER . 3.8 pp -55.82 -32.99 64.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.446 -179.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.777 ' N ' HD12 ' A' ' 125' ' ' LEU . 80.3 p -68.34 -48.16 65.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.294 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.43 HH11 ' HG3' ' A' ' 127' ' ' ARG . 46.2 ttm-85 -65.38 -45.45 84.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 1.4 p -60.75 -44.55 97.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.255 0.55 . . . . 0.0 110.9 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.455 ' N ' ' CG1' ' A' ' 128' ' ' VAL . . . -58.44 -44.21 89.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.457 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.467 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.29 -44.2 98.01 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.785 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.56 HD13 ' HG ' ' A' ' 184' ' ' LEU . 92.6 mt -66.88 -42.42 85.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.28 . . . . 0.0 111.412 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 51.0 mt-10 -64.07 -47.92 78.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.865 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.07 -42.64 90.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.645 0.26 . . . . 0.0 111.154 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.562 ' HB3' HD13 ' A' ' 180' ' ' ILE . 50.8 mm-40 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.92 0.391 . . . . 0.0 110.697 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 135' ' ' LEU . 2.8 tm? -58.76 -40.31 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.426 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' ' 140' ' ' LYS . . . -66.91 -43.34 83.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.385 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 133' ' ' LYS . 64.8 mt -59.99 -49.66 83.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.06 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 11.0 pt-20 -58.12 -43.28 87.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.065 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.3 mt -60.1 -42.24 94.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.665 0.269 . . . . 0.0 111.33 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 136' ' ' ALA . 14.6 mmmm -60.11 -47.31 86.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.711 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 48.4 t -64.56 -42.14 94.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.276 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.03 -50.96 71.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.269 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -64.61 -49.18 72.1 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.246 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -55.51 -36.27 63.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.974 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.2 -40.74 94.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 110.131 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.0 mt-10 -62.07 -44.51 96.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.552 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -60.2 -40.11 88.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.742 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.3 mtp -65.3 -44.58 87.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.2 mt -61.94 -44.2 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.354 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 97.4 mm-40 -67.09 -45.48 77.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.443 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -61.92 -50.34 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.644 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.431 ' HA ' ' O ' ' A' ' 157' ' ' THR . 2.3 m-85 -63.47 -41.66 98.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.644 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 23.9 t -64.33 117.63 7.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.854 0.359 . . . . 0.0 111.113 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 2.9 m120 59.66 113.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.182 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 59.74 156.67 0.03 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.835 178.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 58.5 m 59.62 63.91 1.42 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.582 0.23 . . . . 0.0 111.419 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 152' ' ' TYR . 85.6 m 66.22 143.33 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.98 44.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.875 0.369 . . . . 0.0 111.478 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.64 129.1 38.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.349 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -67.05 -44.14 80.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.364 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -58.4 -48.93 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.764 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.96 -38.13 87.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.1 tp -56.94 -47.71 80.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.06 -41.2 99.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.0 m -60.18 -47.04 87.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.62 75.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.216 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -57.34 -37.23 72.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.984 0.421 . . . . 0.0 109.91 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -60.46 -40.91 92.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.042 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 165' ' ' THR . 40.9 mtm -61.78 -40.68 96.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.195 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 59.8 tp -61.36 -42.17 98.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.969 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' GLN . . . . . 0.782 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 41.2 tt0 -57.86 -49.58 76.2 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.901 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 33.3 m-20 -63.0 -40.85 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.769 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 177' ' ' ILE . 45.7 t -57.88 -44.77 86.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.782 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 53.8 mtmt -58.3 -51.62 69.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.936 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.8 m -55.63 -41.8 74.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.955 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 172' ' ' ASP . 75.7 mmtt -60.88 -43.65 98.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.764 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.516 HG12 ' CD ' ' A' ' 138' ' ' GLU . 49.3 mt -60.93 -44.92 98.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.698 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.93 -47.37 80.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 111.587 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 69.9 mt -64.99 -50.66 73.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.515 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.562 HD13 ' HB3' ' A' ' 134' ' ' GLN . 44.7 mt -59.28 -58.92 4.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.86 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -51.01 -39.03 54.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.051 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.8 ttm -61.15 -39.41 89.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.89 0.376 . . . . 0.0 110.162 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 11.9 mm100 -62.01 -43.37 98.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.876 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.56 ' HG ' HD13 ' A' ' 131' ' ' LEU . 9.5 mp -58.87 -45.97 88.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.859 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.427 ' HG2' HH11 ' A' ' 185' ' ' ARG . 47.5 mtp85 -56.0 -44.35 78.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 186' ' ' ARG . 12.1 tpt180 -60.9 -33.7 73.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.76 -48.77 73.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.646 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 188' ' ' LEU . 3.8 mm? -69.3 -44.4 71.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.581 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 86.3 mt-30 -62.11 -45.58 92.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.493 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.66 -45.39 90.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.444 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.44 -50.68 72.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.052 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -69.61 138.14 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.836 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.514 ' O ' HD13 ' A' ' 193' ' ' LEU . 2.4 tm? -169.72 -45.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.424 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.558 ' HG2' ' H ' ' A' ' 195' ' ' ASN . 70.8 tt0 -68.77 -133.33 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.175 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.558 ' H ' ' HG2' ' A' ' 194' ' ' GLU . 29.6 p-10 -176.15 -39.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -72.09 129.81 39.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.954 0.407 . . . . 0.0 111.166 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -73.39 133.77 43.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.145 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . 64.51 138.36 0.05 OUTLIER Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 32.4 Cg_exo . . . . . 0 C--O 1.25 1.079 0 C-N-CA 122.46 2.107 . . . . 0.0 112.27 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.528 -0.229 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.572 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 2.1 mp -63.99 -50.54 69.07 Favored Pre-proline 0 CA--C 1.533 0.315 0 O-C-N 123.026 -0.102 . . . . 0.0 111.222 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 37.3 Cg_endo -65.25 134.42 39.08 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.174 1.916 . . . . 0.0 112.125 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.74 -39.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.294 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 74.1 p -141.33 -22.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.125 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.446 ' OD1' ' HA ' ' A' ' 121' ' ' PRO . 16.3 p-10 -49.31 -40.05 33.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.354 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.31 -43.35 83.2 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 110.873 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 46.9 t -58.3 -40.19 81.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.595 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 39.8 ttm180 -59.11 -44.33 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.052 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 74.5 t -60.09 -50.67 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.602 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.9 95.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.55 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.84 -41.25 99.13 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.375 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.594 ' HB3' HD21 ' A' ' 184' ' ' LEU . 97.2 mt -67.79 -44.39 77.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.789 0.328 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 65.7 mm-40 -62.82 -47.61 82.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.713 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.65 -42.65 97.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.436 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -59.0 -52.05 67.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.674 0.273 . . . . 0.0 111.159 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.56 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 52.7 tp -52.15 -43.08 63.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.123 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.99 86.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.218 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.9 mt -60.05 -51.37 73.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.585 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.464 ' HG3' ' HE3' ' A' ' 176' ' ' LYS . 5.1 mp0 -60.57 -37.45 81.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.4 mt -59.67 -44.95 93.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.782 0.325 . . . . 0.0 111.06 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -67.91 -46.83 70.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.391 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.0 t -63.01 -46.66 95.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.481 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.496 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 64.0 tttm -62.68 -45.81 91.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.801 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -60.66 -45.88 92.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.64 -39.98 97.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.564 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.44 -42.2 92.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 110.308 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.5 mt-10 -63.58 -40.63 97.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.677 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 54.1 t-20 -56.67 -45.04 81.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.232 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.93 -42.02 81.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 145' ' ' ALA . 88.8 mt -58.39 -44.28 88.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.302 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.2 mt-30 -64.36 -46.35 83.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.456 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.453 HG22 ' OG1' ' A' ' 157' ' ' THR . 52.1 m -62.82 -50.66 70.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.062 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.615 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.8 m-85 -65.29 -43.51 90.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.76 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -57.21 -50.9 71.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.781 0.324 . . . . 0.0 110.552 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -71.28 134.22 46.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.031 179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -55.37 113.63 3.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.55 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 83.2 p -179.58 -52.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.821 0.344 . . . . 0.0 110.619 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.549 HG22 ' H ' ' A' ' 158' ' ' LYS . 6.7 m -74.64 -131.36 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.193 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.549 ' H ' HG22 ' A' ' 157' ' ' THR . 7.8 ptpp? -179.3 -41.12 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.62 0.248 . . . . 0.0 111.49 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -55.8 97.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.983 0.421 . . . . 0.0 111.212 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 28.6 tpt180 -74.29 -45.56 46.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.174 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -54.84 -48.04 73.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.096 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.577 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.7 mt -60.31 -36.84 78.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.796 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' HB2' ' A' ' 152' ' ' TYR . 47.9 tp -56.09 -44.81 79.37 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.93 -43.65 98.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.454 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 91.0 m -62.09 -41.38 98.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -59.09 -42.56 90.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.008 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -59.34 -44.93 92.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.055 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -62.08 -37.54 85.43 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.959 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 169' ' ' MET . 0.0 OUTLIER -58.07 -44.45 87.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.83 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.496 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 51.1 tp -65.37 -40.57 93.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.158 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -59.29 -46.29 88.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.442 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -65.03 -46.05 82.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.551 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.524 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -59.79 -47.4 85.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.605 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -58.52 -42.54 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.598 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.2 m -58.81 -50.6 73.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.744 0.307 . . . . 0.0 111.293 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.464 ' HE3' ' HG3' ' A' ' 138' ' ' GLU . 52.5 mtmt -57.7 -40.84 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.028 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 173' ' ' SER . 73.1 mt -61.58 -38.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.321 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.65 -50.55 72.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.389 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.447 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -64.87 -50.14 76.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.332 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 66.1 mt -59.14 -43.22 88.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.868 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.1 tpt180 -54.83 -43.11 72.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.596 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.0 -44.95 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.606 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -61.97 -36.18 80.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.94 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.6 mm? -69.25 -41.98 76.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.425 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 79.3 mtp180 -58.09 -51.8 68.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 186' ' ' ARG . 3.7 ptp180 -63.35 -36.31 83.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.159 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.27 -44.36 96.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 84.7 mt -64.09 -43.28 95.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.211 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.1 mt-30 -59.9 -46.55 88.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.065 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.92 -43.02 99.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -62.13 -39.09 91.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.939 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -165.48 139.21 4.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.183 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 51.5 tp -171.27 129.04 0.71 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.466 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 195' ' ' ASN . 57.9 mm-40 -69.84 -147.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.112 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.445 ' HB3' ' O ' ' A' ' 194' ' ' GLU . 16.9 t-20 72.51 -57.72 0.62 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.522 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 98.3 mm-40 -68.79 132.16 46.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -66.61 135.05 53.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 64.95 138.26 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.209 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.45 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo . . . . . 0 C--O 1.25 1.077 0 C-N-CA 122.585 2.19 . . . . 0.0 112.282 -179.945 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.561 ' N ' HD12 ' A' ' 120' ' ' ILE . 2.8 mp 56.32 89.48 0.1 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.714 0.292 . . . . 0.0 110.702 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -65.39 -145.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.744 2.296 . . . . 0.0 112.71 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.13 -122.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.395 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.428 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 61.7 p 55.98 -144.81 0.65 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 122.527 0.331 . . . . 0.0 111.407 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 45.25 34.29 1.41 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.324 -179.567 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 123' ' ' THR . 99.6 mt -98.78 -42.27 7.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.7 t -57.74 -44.78 86.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.316 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.526 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 21.3 tpp180 -61.51 -47.27 86.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.208 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.59 -49.45 84.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.586 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.45 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.409 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.506 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.66 -42.33 99.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.394 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.6 ' HB3' HD22 ' A' ' 184' ' ' LEU . 83.2 mt -66.5 -44.19 83.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 0.0 110.954 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -64.26 -47.1 80.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.967 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.628 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -57.53 -42.12 82.24 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.596 0.236 . . . . 0.0 110.944 -179.482 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.531 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 48.6 mm-40 -59.15 -43.68 92.08 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.798 0.332 . . . . 0.0 110.518 179.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 89.9 mt -60.04 -40.93 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.005 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.54 -47.37 86.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.164 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -58.78 -38.93 75.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.811 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.637 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.9 mm-40 -59.44 -46.58 88.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.235 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.4 mt -59.76 -39.81 86.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.274 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -61.46 -47.77 84.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.138 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.4 -47.1 68.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.509 ' HE3' ' HD3' ' A' ' 174' ' ' LYS . 87.2 tttt -58.45 -49.51 77.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.191 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -59.71 -43.68 94.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.562 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.09 -41.38 94.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.367 179.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.463 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.36 -40.97 94.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.056 0.455 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 56.6 mt-10 -62.75 -40.02 95.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.469 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -58.03 -45.44 86.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.756 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 44.3 mtm -64.78 -47.23 78.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.938 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.5 mt -55.21 -45.58 77.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.03 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.4 mt-30 -64.54 -40.8 96.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.781 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.453 HG22 ' OG1' ' A' ' 157' ' ' THR . 85.1 m -60.33 -45.57 92.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.242 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.412 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.0 m-30 -66.29 -44.53 83.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.936 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 80.0 p -66.13 -24.17 66.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.017 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -50.93 -63.15 1.22 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.41 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 160.49 -48.72 0.38 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.309 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -60.11 -71.11 0.14 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.672 0.272 . . . . 0.0 111.252 -179.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.453 ' OG1' HG22 ' A' ' 151' ' ' THR . 76.2 p -73.01 136.94 45.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.617 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -147.85 40.19 0.97 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.642 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 163' ' ' LEU . 1.5 m-20 -68.31 118.95 12.07 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 179.193 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -73.69 -45.0 55.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.719 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 161' ' ' LYS . 0.7 OUTLIER -56.98 -51.41 69.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.325 -179.488 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.4 mp -70.57 -31.66 68.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.589 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 159' ' ' ASP . 65.0 tp -56.59 -52.02 66.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.837 0.351 . . . . 0.0 110.417 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.73 -39.38 93.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.014 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 169' ' ' MET . 92.7 m -58.48 -39.94 81.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.669 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.59 94.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.777 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -56.89 -44.47 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.293 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.3 tp60 -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.291 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 165' ' ' THR . 77.9 mmm -63.03 -49.96 72.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.138 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.494 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -58.03 -46.6 85.05 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.609 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -64.94 -40.87 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.179 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.2 -47.63 85.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.31 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -60.27 -44.32 95.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.154 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.583 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.93 -42.16 84.28 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.202 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.2 m -60.45 -47.26 86.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.143 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -62.21 -43.16 99.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.932 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.637 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.9 mt -60.83 -44.14 97.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -56.41 -43.39 79.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.912 0.387 . . . . 0.0 110.334 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.497 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 68.2 mt -61.73 -44.8 99.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.819 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.43 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 70.2 mt -61.08 -45.81 97.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.436 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' A' ' 184' ' ' LEU . 29.2 tpt180 -53.71 -46.98 70.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.77 0.319 . . . . 0.0 110.813 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.6 mmt -59.24 -38.94 81.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.288 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 84.7 mt-30 -64.85 -36.34 84.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.028 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 131' ' ' LEU . 9.4 mt -60.19 -50.87 71.97 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.185 0.517 . . . . 0.0 110.818 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 99.3 mtt180 -61.64 -45.82 92.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.14 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.401 ' HA ' ' CG ' ' A' ' 189' ' ' GLN . 79.8 ttt180 -66.44 -33.85 76.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.208 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.52 93.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.765 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 31.9 tp -72.55 -47.38 48.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.555 ' HB2' HD12 ' A' ' 193' ' ' LEU . 14.1 pt20 -58.15 -49.29 77.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.72 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -64.34 -42.73 96.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.407 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.16 -36.39 81.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.94 0.4 . . . . 0.0 110.521 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -168.46 140.31 2.78 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.87 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.555 HD12 ' HB2' ' A' ' 189' ' ' GLN . 1.0 OUTLIER -168.89 47.22 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.481 . . . . 0.0 110.098 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -72.44 -50.52 25.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.975 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -68.43 136.53 53.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -60.48 139.16 57.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.011 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.27 129.2 39.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -175.85 55.86 0.14 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.212 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--O 1.249 1.029 0 C-N-CA 122.392 2.061 . . . . 0.0 112.352 -179.978 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 46.5 mm -64.11 122.62 78.58 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.61 0.243 . . . . 0.0 111.176 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.03 -45.15 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.474 2.116 . . . . 0.0 111.998 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.35 129.12 0.45 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.936 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 92.4 m -165.21 -36.17 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -57.89 -39.02 76.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.743 HD12 ' N ' ' A' ' 126' ' ' SER . 3.8 pp -56.92 -31.74 65.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.743 ' N ' HD12 ' A' ' 125' ' ' LEU . 49.6 m -60.1 -42.18 94.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -59.97 -47.02 87.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.705 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -63.14 -40.04 87.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.974 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.39 98.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.807 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -64.34 -46.94 89.25 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.702 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.471 ' HB3' HD22 ' A' ' 184' ' ' LEU . 79.6 mt -66.86 -41.13 87.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.997 0.427 . . . . 0.0 111.06 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -62.55 -48.35 79.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.807 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.5 pttt -60.62 -40.5 92.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.546 0.212 . . . . 0.0 111.118 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 30.8 mm100 -58.55 -44.56 89.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.893 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.579 HD21 HD11 ' A' ' 184' ' ' LEU . 95.6 mt -60.21 -42.2 94.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.09 -45.3 95.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.08 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.508 ' O ' HG23 ' A' ' 141' ' ' VAL . 67.5 mt -62.26 -42.85 96.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.101 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.684 ' HB3' HD11 ' A' ' 177' ' ' ILE . 59.3 mm-40 -59.29 -45.96 89.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.327 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.6 mt -58.72 -41.55 86.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.009 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -64.99 -45.74 84.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.164 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.1 t -65.2 -46.08 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.484 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -63.69 -47.15 82.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.102 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -60.71 -45.27 94.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -65.77 -35.18 90.6 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.421 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.558 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.23 -43.64 81.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.993 0.425 . . . . 0.0 110.53 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.8 mt-10 -60.94 -41.18 95.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.784 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 51.1 m-20 -59.0 -46.14 88.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.636 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.468 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 83.3 mtp -63.44 -47.07 83.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.921 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 145' ' ' ALA . 83.1 mt -53.01 -47.92 53.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.987 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.42 -35.88 80.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.121 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.566 HG22 HG21 ' A' ' 157' ' ' THR . 98.8 m -58.18 -52.7 64.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.064 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.759 ' HB2' HD13 ' A' ' 163' ' ' LEU . 21.3 m-85 -74.67 -47.34 32.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.706 0.288 . . . . 0.0 111.377 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 53.1 m -62.14 131.8 50.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.39 . . . . 0.0 111.442 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 55.37 44.34 27.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.66 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 173.69 128.74 1.1 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.08 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 80.0 p -69.78 140.85 53.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.607 0.241 . . . . 0.0 110.385 179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.566 HG21 HG22 ' A' ' 151' ' ' THR . 5.8 t -169.15 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.751 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.716 ' HG2' ' H ' ' A' ' 159' ' ' ASP . 4.1 ttmp? -170.67 -179.77 3.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.62 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.716 ' H ' ' HG2' ' A' ' 158' ' ' LYS . 60.1 m-20 -54.55 142.36 28.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.107 0.479 . . . . 0.0 111.926 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 39.7 mmt180 -64.24 -22.15 66.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.13 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -52.8 -42.23 64.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.063 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 152' ' ' TYR . 3.6 mm? -65.55 -40.0 92.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.601 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 152' ' ' TYR . 56.0 tp -57.22 -44.53 83.82 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.542 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.38 -41.25 96.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.248 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.432 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.1 m -59.56 -42.95 93.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.588 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.94 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.711 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.37 -45.82 90.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 15.4 tm0? -66.2 -38.78 88.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.454 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.432 ' HG3' ' O ' ' A' ' 165' ' ' THR . 73.3 mtp -59.94 -48.36 82.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.032 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 57.2 tp -58.42 -46.2 86.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.256 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -63.87 -43.96 94.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.259 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.69 -45.78 92.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.164 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.57 ' HA ' ' NZ ' ' A' ' 176' ' ' LYS . 80.8 p -61.04 -45.55 94.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.89 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 58.2 mtpt -59.89 -38.66 82.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.018 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.8 m -58.61 -48.05 82.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.963 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 173' ' ' SER . 37.3 mtmm -63.53 -40.54 97.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.876 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.684 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.2 mt -60.32 -40.16 83.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.209 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.92 -47.35 85.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.408 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 63.1 mt -62.73 -48.59 87.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.016 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 64.5 mt -60.68 -40.09 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.605 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -53.87 -45.14 70.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.352 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.52 -39.85 92.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.186 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 9.9 mm100 -62.05 -43.07 99.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.145 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.579 HD11 HD21 ' A' ' 135' ' ' LEU . 9.3 mt -58.75 -51.15 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.104 0.478 . . . . 0.0 110.624 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.478 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 44.5 mmm-85 -57.2 -41.83 80.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.789 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 52.7 ttp85 -64.12 -37.01 85.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.414 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.12 -46.57 88.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.492 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 184' ' ' LEU . 4.1 mm? -65.62 -42.22 91.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.458 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.1 mt-30 -61.22 -44.06 97.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.606 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.49 -52.62 51.5 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -64.31 -45.39 88.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.786 0.327 . . . . 0.0 111.521 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -79.44 42.77 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.019 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.467 ' C ' HD13 ' A' ' 193' ' ' LEU . 2.7 tm? -174.34 122.03 0.28 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.256 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.431 ' N ' HD13 ' A' ' 193' ' ' LEU . 43.7 tt0 58.64 115.61 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.356 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -74.4 131.45 41.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -64.65 139.66 58.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.575 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.08 136.4 52.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.964 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . -167.8 136.97 2.08 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.205 -179.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 39.2 Cg_exo . . . . . 0 C--O 1.248 1.021 0 C-N-CA 122.568 2.179 . . . . 0.0 112.318 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.922 HD12 ' HD2' ' A' ' 121' ' ' PRO . 6.6 tp -174.13 124.1 0.4 Allowed Pre-proline 0 CA--C 1.532 0.257 0 CA-C-O 120.705 0.288 . . . . 0.0 111.029 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.922 ' HD2' HD12 ' A' ' 120' ' ' ILE . 29.6 Cg_endo -63.45 141.98 83.07 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.452 2.101 . . . . 0.0 111.904 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.06 119.45 5.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.127 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 99.1 m -167.33 -47.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.664 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.563 ' HA ' HH12 ' A' ' 127' ' ' ARG . 41.2 m-20 -61.24 -36.95 81.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.976 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.9 mt -54.46 -39.52 67.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.056 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.8 t -61.12 -44.93 96.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.804 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.563 HH12 ' HA ' ' A' ' 124' ' ' ASN . 18.3 ttp-105 -66.05 -46.2 78.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.082 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 73.7 t -59.14 -50.51 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.418 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.07 85.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.269 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.84 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.14 -44.19 98.46 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.342 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.673 HD13 ' HG ' ' A' ' 184' ' ' LEU . 74.1 mt -66.83 -42.73 85.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.895 0.379 . . . . 0.0 110.882 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.5 mt-10 -62.86 -48.42 79.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.923 -179.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.84 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.7 pttp -59.48 -40.59 87.47 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.013 -179.359 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.503 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 28.8 mm100 -58.2 -44.71 88.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 110.797 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.6 mt -60.39 -44.66 95.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.29 95.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.319 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 133' ' ' LYS . 74.7 mt -59.79 -42.27 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.638 ' HB3' HD11 ' A' ' 177' ' ' ILE . 66.4 mm-40 -62.41 -41.73 98.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.369 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 98.3 mt -60.42 -40.21 90.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.372 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.55 -48.76 76.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.363 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 49.0 t -67.82 -47.29 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.489 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.4 tttm -59.36 -46.6 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.087 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.04 -46.28 89.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.645 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -60.6 -35.29 89.02 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.966 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.72 -40.5 92.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.872 0.367 . . . . 0.0 110.125 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 94.9 mt-10 -60.23 -42.44 95.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.546 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -59.69 -45.89 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.835 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 88.5 mmm -67.72 -44.29 77.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.249 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.609 HD12 HD12 ' A' ' 170' ' ' LEU . 91.2 mt -61.8 -46.62 96.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.674 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -64.76 -42.91 94.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.816 0.341 . . . . 0.0 111.204 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.675 HG22 ' OG1' ' A' ' 157' ' ' THR . 99.5 m -63.34 -48.6 77.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.494 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.527 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 2.1 m-30 -69.15 -40.4 78.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.994 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 79.7 p -54.49 -36.78 64.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.536 -179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -158.12 133.26 8.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.95 0.405 . . . . 0.0 111.169 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.96 -141.62 12.98 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.104 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 50.0 m -71.3 -51.29 25.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.071 0.462 . . . . 0.0 110.173 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.675 ' OG1' HG22 ' A' ' 151' ' ' THR . 75.0 p -82.84 142.65 31.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.875 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' LYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 152' ' ' TYR . 18.5 ptpt -166.95 38.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.357 . . . . 0.0 111.387 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.499 ' HB3' ' HB2' ' A' ' 162' ' ' LEU . 9.9 t0 -72.53 131.06 42.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.943 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -68.29 -48.71 64.23 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.25 -49.76 76.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 0.0 110.477 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.527 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 94.1 mt -63.26 -35.5 80.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.544 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.562 HD13 ' C ' ' A' ' 163' ' ' LEU . 3.1 tm? -54.49 -58.04 9.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.934 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.0 mt -54.73 -37.09 65.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.4 m -57.54 -50.17 73.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.21 97.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.439 ' OE1' HD13 ' A' ' 149' ' ' ILE . 14.1 mm-40 -57.12 -44.72 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.394 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -37.57 87.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 74.5 mtp -61.15 -50.77 71.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.445 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.609 HD12 HD12 ' A' ' 149' ' ' ILE . 3.5 tt -64.7 -46.74 81.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.682 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 171' ' ' GLN . . . . . 0.479 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 66.2 tt0 -56.49 -44.55 80.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 176' ' ' LYS . 34.5 t70 -62.15 -42.12 98.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 177' ' ' ILE . 59.9 m -59.69 -48.19 82.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.374 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.479 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 55.2 mtmt -57.22 -49.27 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 111.38 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.4 m -55.59 -46.9 77.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.296 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.505 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 53.6 mtmt -59.6 -40.94 89.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 138' ' ' GLU . 65.4 mt -63.9 -38.45 82.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.015 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -57.57 -48.33 79.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.353 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.56 -40.25 83.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.36 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.47 ' O ' HD13 ' A' ' 184' ' ' LEU . 56.5 mt -57.45 -55.59 20.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.094 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -51.21 -40.04 57.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.007 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.413 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 80.6 mtp -60.03 -39.42 85.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.304 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -68.03 -43.15 79.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.673 ' HG ' HD13 ' A' ' 131' ' ' LEU . 10.0 mp -62.78 -49.58 74.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.365 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.697 ' HD3' ' N ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -60.73 -36.45 78.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.724 0.297 . . . . 0.0 110.451 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.697 ' N ' ' HD3' ' A' ' 185' ' ' ARG . 22.4 tpp180 -65.28 -42.37 93.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.153 179.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.79 -37.29 86.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.787 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 24.7 tp -68.04 -48.12 66.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.064 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 12.0 mm100 -58.97 -42.69 90.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.985 0.421 . . . . 0.0 110.611 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.27 -37.17 80.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.781 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -56.12 -53.81 52.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.458 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -67.1 -28.98 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.966 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 58.0 tp -68.09 73.09 0.19 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.139 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.415 ' HB2' ' OE1' ' A' ' 196' ' ' GLN . 24.7 pt-20 40.48 -145.19 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.564 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 19.5 p30 -174.14 -44.38 0.01 OUTLIER 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.6 0.238 . . . . 0.0 111.223 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 196' ' ' GLN . . . . . 0.479 ' H ' ' CD ' ' A' ' 196' ' ' GLN . 0.0 OUTLIER -71.52 137.56 48.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.786 0.327 . . . . 0.0 110.849 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.72 133.21 55.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 64.26 133.22 0.03 OUTLIER Pre-proline 0 C--N 1.333 -0.145 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.446 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 C--O 1.249 1.043 0 C-N-CA 122.556 2.171 . . . . 0.0 112.232 179.971 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . 0.593 ' N ' ' HB2' ' A' ' 126' ' ' SER . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.616 -0.194 . . . . 0.0 112.616 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.657 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 49.1 mm -59.42 -47.5 97.85 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.657 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 11.7 Cg_endo -55.16 154.3 23.37 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.471 2.114 . . . . 0.0 112.264 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.544 ' HB3' HD23 ' A' ' 125' ' ' LEU . . . 68.83 47.64 0.8 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.288 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 82.6 p 49.75 45.44 24.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.979 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 55.56 58.59 4.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.242 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.74 HD12 ' N ' ' A' ' 126' ' ' SER . 3.0 pp -53.38 -24.83 13.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.257 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.74 ' N ' HD12 ' A' ' 125' ' ' LEU . 43.4 t -56.08 -46.54 78.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.255 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -60.44 -44.71 95.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.949 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.491 HG12 ' OE2' ' A' ' 132' ' ' GLU . 50.8 t -59.68 -44.02 92.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.11 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -62.55 -41.18 98.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.099 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.49 -39.77 97.78 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.821 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.679 ' O ' ' HG2' ' A' ' 134' ' ' GLN . 84.8 mt -70.71 -38.74 73.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.722 0.296 . . . . 0.0 111.192 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.491 ' OE2' HG12 ' A' ' 128' ' ' VAL . 49.6 mt-10 -67.28 -48.31 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.495 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -63.45 -41.71 98.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.187 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.894 ' HG3' HD13 ' A' ' 180' ' ' ILE . 1.5 pt20 -60.41 -43.11 97.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.897 0.38 . . . . 0.0 110.206 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -54.25 -42.16 69.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -64.76 -37.04 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.765 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 134' ' ' GLN . 69.0 mt -53.37 -49.46 53.31 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.72 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.572 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -61.69 -45.96 91.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.535 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.47 -38.21 71.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.379 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 98.3 mttt -63.45 -51.37 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.254 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.9 t -64.92 -44.18 96.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.246 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.457 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttp -59.23 -46.14 89.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -61.72 -42.3 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.869 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.58 -41.13 97.14 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.585 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.63 -44.59 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 110.293 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 50.3 mt-10 -60.19 -40.27 89.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 52.4 m-20 -57.93 -47.95 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.94 -42.32 81.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.262 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 145' ' ' ALA . 96.2 mt -53.93 -46.88 64.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 95.4 mm-40 -65.2 -39.77 93.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.184 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.6 m -64.68 -46.25 83.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.902 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.724 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.9 m-85 -65.91 -42.15 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.985 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 88.0 p -52.03 -43.64 63.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.59 0.233 . . . . 0.0 110.897 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -175.46 124.95 0.23 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.848 179.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 168.67 -56.28 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.691 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.3 t -179.86 45.13 0.0 OUTLIER 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.814 0.34 . . . . 0.0 110.649 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.704 HG23 ' HA ' ' A' ' 152' ' ' TYR . 9.2 t -175.34 159.28 2.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -149.31 24.65 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.078 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.83 71.83 2.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.182 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 38.8 ttm180 -53.42 -30.22 39.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.903 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.478 ' HD3' ' C ' ' A' ' 161' ' ' LYS . 7.3 tmtm? -53.28 -55.48 24.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.015 0.436 . . . . 0.0 109.964 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.724 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 92.9 mt -64.27 -32.68 74.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.216 179.008 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 47.8 tp -56.33 -51.9 66.55 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.31 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.58 -42.85 79.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.4 m -56.55 -41.79 77.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.202 0.525 . . . . 0.0 109.661 178.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.51 76.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.507 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 14.2 mm100 -56.45 -44.35 80.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.138 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.0 tp60 -65.69 -40.19 92.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.124 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.8 mtp -56.73 -47.58 79.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.989 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 54.5 tp -60.32 -45.49 93.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.323 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -59.68 -47.05 87.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.037 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.19 -40.8 97.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.812 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 177' ' ' ILE . 48.8 m -59.97 -45.87 91.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.909 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.5 mtpp -58.84 -41.25 86.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.977 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.6 m -58.77 -44.32 90.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.739 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -62.58 -41.53 99.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.572 HG12 ' HB3' ' A' ' 138' ' ' GLU . 62.1 mt -58.56 -42.9 85.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 178' ' ' ASP . . . . . 0.495 ' HA ' ' HE ' ' A' ' 181' ' ' ARG . 27.2 m-20 -61.44 -41.01 96.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.33 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.86 -44.12 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.127 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.894 HD13 ' HG3' ' A' ' 134' ' ' GLN . 53.5 mt -58.74 -48.79 84.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.806 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.495 ' HE ' ' HA ' ' A' ' 178' ' ' ASP . 84.8 mtm180 -53.96 -40.8 67.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.563 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 25.8 mmt -60.05 -46.54 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.565 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.4 -41.98 90.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.911 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.659 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.3 mm? -61.05 -42.31 98.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.201 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 71.3 mtt-85 -58.01 -51.27 70.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 182' ' ' MET . 10.5 mpt_? -66.04 -36.81 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.812 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -59.46 -42.72 92.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 94.1 mt -63.84 -44.0 94.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.732 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 189' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -60.86 -45.26 95.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.207 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -61.65 -47.51 85.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.35 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -62.78 -44.28 96.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.011 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -78.3 43.4 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.468 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.519 HD13 ' N ' ' A' ' 194' ' ' GLU . 3.0 tm? -174.05 127.56 0.37 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.377 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.519 ' N ' HD13 ' A' ' 193' ' ' LEU . 56.9 mt-10 -153.66 -144.42 0.15 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.564 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -68.77 137.94 54.42 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.768 0.318 . . . . 0.0 110.921 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 7.6 pm0 -58.71 138.04 57.28 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.814 179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.38 133.51 55.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.136 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -64.24 137.84 97.24 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo . . . . . 0 C--O 1.248 1.005 0 C-N-CA 122.595 2.197 . . . . 0.0 112.163 179.952 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.151 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.541 ' N ' ' HD3' ' A' ' 121' ' ' PRO . 31.3 pt 37.75 56.4 4.31 Favored Pre-proline 0 N--CA 1.466 0.335 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.541 ' HD3' ' N ' ' A' ' 120' ' ' ILE . 21.4 Cg_exo -65.41 -142.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.571 2.181 . . . . 0.0 112.194 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.78 -57.02 7.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.096 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 82.1 p -78.68 117.35 19.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.042 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 128' ' ' VAL . 44.0 t30 177.41 -48.15 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.104 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.55 -45.3 94.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.571 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.4 t -62.26 -45.72 92.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.517 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -63.81 -45.21 90.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.565 -179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 124' ' ' ASN . 69.2 t -61.27 -48.28 89.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.677 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.97 95.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.569 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.592 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -65.07 -48.53 69.75 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.909 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.664 ' HB3' HD21 ' A' ' 184' ' ' LEU . 90.3 mt -64.94 -41.59 95.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.924 0.393 . . . . 0.0 111.31 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -61.09 -51.09 70.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.864 -179.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 14.8 ptmm? -59.48 -39.21 83.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.239 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.5 mm-40 -58.21 -44.44 88.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.713 0.292 . . . . 0.0 110.999 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.8 mt -58.77 -44.13 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.306 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.75 84.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.436 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.09 -42.49 86.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.354 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.729 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.7 mm-40 -60.06 -43.44 95.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.32 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 88.5 mt -58.42 -43.07 88.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.051 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -59.77 -48.45 81.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.508 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.8 t -68.61 -46.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.524 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 37.4 ttmt -59.25 -49.23 78.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.399 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -63.36 -42.34 98.88 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.809 0.338 . . . . 0.0 110.784 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.79 -39.16 94.99 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.947 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -64.63 -40.05 94.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.106 0.479 . . . . 0.0 109.92 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 142' ' ' LYS . 64.8 mm-40 -59.81 -39.42 84.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.341 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 36.8 m-20 -60.61 -44.05 96.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.231 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 80.5 mtp -67.09 -41.31 86.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.228 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.0 mt -61.14 -49.26 85.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.667 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -68.98 -44.14 73.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.6 m -64.66 -47.09 79.75 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.752 0.311 . . . . 0.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.457 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 1.4 m-30 -74.87 9.12 2.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.578 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 73.4 m -67.35 -49.4 64.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.641 0.258 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -157.44 -49.87 0.07 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -64.93 144.38 48.01 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.367 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.0 t 61.45 -117.1 0.67 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.282 0.087 . . . . 0.0 110.853 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 89.5 m -51.27 128.57 22.58 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.923 0.392 . . . . 0.0 111.252 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -102.48 -37.78 7.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.051 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -55.15 111.92 0.96 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.476 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.933 ' HG3' HD23 ' A' ' 163' ' ' LEU . 55.2 ttp180 -74.85 -12.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.092 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -52.58 -50.3 63.26 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.435 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 162' ' ' LEU . 3.7 mm? -67.24 -33.85 76.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.001 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.933 HD23 ' HG3' ' A' ' 160' ' ' ARG . 61.1 tp -56.57 -44.62 81.15 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.418 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.98 -44.82 91.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.606 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 88.1 m -58.98 -43.12 91.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.916 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -60.47 -41.23 93.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 36.7 mt-30 -59.14 -42.76 91.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.164 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -59.22 -41.22 88.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.436 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.43 ' HB2' ' O ' ' A' ' 166' ' ' ALA . 71.6 mmm -56.42 -45.98 80.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.624 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.508 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 56.9 tp -58.28 -44.64 88.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.047 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -58.45 -43.75 88.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.382 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.48 -47.2 87.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.255 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 80.5 p -64.48 -45.41 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.541 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 29.4 mtpp -57.17 -44.16 83.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.48 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.9 m -59.16 -50.16 75.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 111.047 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -59.21 -42.25 90.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.869 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.729 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -62.07 -34.6 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.028 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -61.2 -50.75 71.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.662 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.79 -47.23 93.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.485 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.4 mt -58.51 -44.15 88.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.763 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.419 ' HG3' HH11 ' A' ' 181' ' ' ARG . 29.9 tpt85 -53.81 -42.81 68.78 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.345 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.78 -38.9 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.5 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -64.15 -45.22 89.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.042 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.4 mm? -61.67 -53.17 59.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.623 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.502 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 16.0 ptp180 -57.69 -39.55 77.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.63 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -63.28 -39.94 96.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.703 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -61.9 -44.12 97.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.218 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 184' ' ' LEU . 10.1 mp -65.87 -41.84 91.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.441 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 12.3 mm100 -61.53 -45.92 92.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.748 0.309 . . . . 0.0 111.161 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.51 -49.78 65.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.782 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -65.88 -58.62 5.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.17 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -69.76 121.36 17.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.021 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.548 HD22 ' H ' ' A' ' 194' ' ' GLU . 0.9 OUTLIER 179.88 -133.3 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.548 ' H ' HD22 ' A' ' 193' ' ' LEU . 23.9 pt-20 -170.8 -45.29 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.766 0.317 . . . . 0.0 110.518 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 195' ' ' ASN . . . . . 0.538 ' H ' HD22 ' A' ' 193' ' ' LEU . 52.4 t-20 -178.91 128.91 0.11 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.301 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -64.75 142.89 58.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.189 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.96 133.89 56.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.04 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -172.91 138.44 0.85 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.053 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo . . . . . 0 C--O 1.249 1.06 0 C-N-CA 122.549 2.166 . . . . 0.0 112.226 179.797 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.603 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 68.1 mt -60.05 -49.53 90.61 Favored Pre-proline 0 CA--C 1.533 0.307 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 25.9 Cg_endo -62.07 141.54 89.17 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.268 1.979 . . . . 0.0 112.189 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 66.69 148.37 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.337 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.9 m 66.4 53.29 1.0 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.761 -179.677 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.627 ' HB2' HG21 ' A' ' 128' ' ' VAL . 16.0 p-10 -171.91 129.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.519 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.4 mt -152.71 -132.23 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.913 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.0 p -52.96 -36.1 59.69 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.43 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.465 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 47.6 ttm-85 -57.49 -49.41 76.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.157 -179.744 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.627 HG21 ' HB2' ' A' ' 124' ' ' ASN . 61.7 t -65.63 -52.05 55.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.894 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.19 -39.27 75.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.374 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.587 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.84 -44.6 97.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.481 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 184' ' ' LEU . 87.9 mt -66.51 -47.59 72.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.015 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -57.31 -49.15 77.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.676 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.591 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -59.96 -36.03 76.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.608 0.242 . . . . 0.0 110.833 -179.731 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.805 ' HB3' HD13 ' A' ' 180' ' ' ILE . 90.5 mm-40 -57.57 -49.29 76.86 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.677 0.275 . . . . 0.0 110.862 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.3 mm? -58.98 -38.44 79.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.981 0.419 . . . . 0.0 110.968 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.44 83.97 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.743 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.462 ' O ' HG23 ' A' ' 141' ' ' VAL . 65.5 mt -65.3 -50.7 71.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.759 -179.414 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.522 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -55.0 -46.53 75.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.808 -179.441 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.8 mt -62.3 -41.07 98.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.721 0.296 . . . . 0.0 110.866 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -62.21 -44.62 96.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.692 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 141' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.8 t -64.91 -43.69 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.974 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.503 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.62 -45.68 93.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.624 179.804 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -62.69 -45.9 90.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.464 179.616 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.3 -37.7 93.46 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.124 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.53 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -64.26 -39.38 93.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.077 0.465 . . . . 0.0 110.014 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -62.84 -46.29 88.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.283 179.324 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -55.89 -40.52 73.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.109 179.346 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.541 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.6 mmm -61.87 -47.31 85.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.747 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 68.9 mt -56.31 -50.84 69.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.929 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.85 -38.72 82.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.495 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.3 m -58.25 -45.93 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.408 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.8 m-85 -69.79 -36.67 75.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.31 -179.938 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 43.7 t -52.02 -49.55 63.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.752 -179.784 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 -71.35 137.19 48.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.661 179.425 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -59.24 105.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.298 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.3 t 178.43 -42.88 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.865 0.364 . . . . 0.0 110.604 -179.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 60.2 p -148.13 47.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.7 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -78.35 50.15 0.91 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.345 -179.618 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.579 ' HB2' ' HB2' ' A' ' 162' ' ' LEU . 1.5 m-20 -62.05 132.83 54.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 22.8 tpp180 -73.1 -54.86 7.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.608 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 161' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 60.8 pttt -64.23 -48.55 75.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.691 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 159' ' ' ASP . 90.2 mt -59.12 -40.75 86.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.37 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 51.7 tp -60.57 -42.78 97.33 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.408 179.877 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 160' ' ' ARG . 97.3 mt -55.33 -41.26 72.19 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.022 0.439 . . . . 0.0 109.95 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.417 ' O ' ' HG2' ' A' ' 169' ' ' MET . 89.4 m -60.38 -45.02 95.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.89 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.76 -45.47 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.395 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -56.13 -44.36 79.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 98.2 mm-40 -62.37 -38.04 88.03 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.452 179.13 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 165' ' ' THR . 72.5 mmm -62.39 -46.09 90.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.132 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.53 HD23 ' HB3' ' A' ' 145' ' ' ALA . 3.2 tm? -58.97 -46.76 87.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.784 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.54 -43.13 85.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.172 -179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -60.98 -45.07 96.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.082 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.531 ' O ' HG13 ' A' ' 177' ' ' ILE . 85.1 p -58.46 -45.31 88.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.871 -179.767 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -57.17 -42.67 81.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.754 179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 79.7 m -59.57 -44.36 93.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.585 179.623 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.2 mtpp -61.08 -41.92 97.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.48 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 173' ' ' SER . 64.4 mt -58.53 -41.02 80.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.836 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.41 -46.09 91.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.369 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.11 -46.16 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.437 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.805 HD13 ' HB3' ' A' ' 134' ' ' GLN . 69.8 mt -59.17 -40.61 81.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.29 179.28 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -55.24 -42.55 73.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.375 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -61.75 -40.47 95.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.459 179.408 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -64.44 -41.65 96.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 131' ' ' LEU . 4.5 mm? -64.38 -50.95 65.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.595 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.523 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 15.7 ptp180 -57.86 -44.74 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.654 0.264 . . . . 0.0 111.166 -179.344 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -64.44 -41.46 96.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.343 . . . . 0.0 110.953 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -61.94 -45.21 94.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.001 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 192' ' ' GLN . 92.5 mt -60.46 -45.57 93.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 30.9 mm100 -57.39 -38.28 74.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.026 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.18 85.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.427 -179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.14 -52.24 56.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.322 -179.787 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 188' ' ' LEU . 13.0 pt20 -70.77 134.57 47.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.971 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.616 HD13 ' N ' ' A' ' 194' ' ' GLU . 2.6 tm? -175.99 129.7 0.24 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.932 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 194' ' ' GLU . . . . . 0.616 ' N ' HD13 ' A' ' 193' ' ' LEU . 5.7 tp10 -174.26 134.52 0.42 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.13 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 63.61 126.61 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.177 179.682 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -68.28 131.91 46.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.878 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -64.28 139.43 58.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.219 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 61.06 62.48 2.75 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.419 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.598 2.199 . . . . 0.0 112.218 -179.99 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 112.584 -0.206 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 10.9 tt -61.17 129.03 90.34 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.581 0.229 . . . . 0.0 111.116 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.404 ' HG2' ' H ' ' A' ' 122' ' ' ALA . 45.7 Cg_endo -69.81 -69.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.223 1.949 . . . . 0.0 112.422 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.404 ' H ' ' HG2' ' A' ' 121' ' ' PRO . . . 179.36 -54.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.204 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.3 p -83.39 33.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.506 -179.775 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -76.34 -42.45 44.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.868 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 93.6 mt -58.59 -43.2 89.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.056 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 81.0 p -64.84 -42.39 94.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 19.7 ttm105 -62.49 -47.71 82.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.299 -179.712 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.04 -49.82 73.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.978 -179.429 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.01 95.86 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 -179.051 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.09 -51.44 56.86 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.796 -179.619 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 184' ' ' LEU . 88.7 mt -65.77 -38.2 88.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.845 0.355 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -62.06 -49.07 77.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.916 -179.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.498 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -61.72 -40.76 96.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.045 -179.377 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.792 ' HB3' HD13 ' A' ' 180' ' ' ILE . 50.0 mm-40 -58.56 -44.93 89.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.747 0.308 . . . . 0.0 110.836 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' HE ' ' A' ' 181' ' ' ARG . 98.6 mt -62.53 -36.4 82.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.136 0.494 . . . . 0.0 111.041 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 136' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -67.4 -48.57 66.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.433 -179.786 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.46 -47.33 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.936 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.538 ' CG ' HG12 ' A' ' 177' ' ' ILE . 12.2 pt-20 -58.28 -39.61 79.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.15 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.497 ' C ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -70.18 -39.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.53 -179.925 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 68.4 mttm -59.34 -48.04 83.14 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.818 0.342 . . . . 0.0 110.735 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.46 -40.89 87.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.532 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.1 tttm -59.67 -44.49 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.737 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -65.24 -42.38 93.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.56 -40.94 95.22 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.476 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.462 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.64 -40.65 92.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.307 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.27 -39.78 94.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 179.507 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 46.6 m-20 -59.06 -44.13 91.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.492 179.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.88 -45.67 88.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.088 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 145' ' ' ALA . 68.4 mt -57.88 -47.06 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.33 -47.58 73.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.765 -179.483 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 92.6 m -61.26 -47.84 84.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.898 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.611 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.5 m-85 -66.35 -26.07 67.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.997 -179.292 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 68.4 m -47.14 -40.69 16.19 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.799 0.333 . . . . 0.0 110.771 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -171.37 118.51 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.867 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 146.14 -141.56 9.75 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.675 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.6 t -80.59 143.05 33.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.243 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.438 HG22 ' O ' ' A' ' 157' ' ' THR . 17.6 m 61.53 48.41 5.84 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 179.608 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -82.26 39.82 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.101 179.848 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.06 133.04 49.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.92 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 43.6 mmm-85 -73.09 -41.13 64.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.63 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -55.57 -53.35 57.56 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.293 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.611 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 93.0 mt -64.38 -34.92 79.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.91 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 56.8 tp -55.28 -48.93 73.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.759 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.41 -42.33 98.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.397 179.681 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.8 m -59.02 -42.03 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.972 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.4 94.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -57.5 -44.64 85.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.273 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -61.33 -40.38 94.0 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.475 179.241 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.9 mtp -58.77 -47.66 83.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.441 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.897 HD22 ' HE3' ' A' ' 174' ' ' LYS . 2.0 tt -60.87 -40.69 93.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.963 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -59.49 -41.46 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 179.479 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -61.68 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.839 179.869 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 177' ' ' ILE . 94.1 p -59.1 -40.21 84.64 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.384 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.897 ' HE3' HD22 ' A' ' 170' ' ' LEU . 99.6 mttt -57.29 -44.19 83.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.388 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.2 m -59.82 -48.13 82.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.36 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.565 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 3.4 mmmp? -62.28 -47.32 84.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.992 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.538 HG12 ' CG ' ' A' ' 138' ' ' GLU . 60.6 mt -57.62 -46.31 86.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.71 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -58.84 -47.3 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.663 0.268 . . . . 0.0 111.532 -179.56 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.65 -50.58 75.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.9 -179.417 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.792 HD13 ' HB3' ' A' ' 134' ' ' GLN . 66.0 mt -61.3 -44.41 98.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.558 ' HE ' HD22 ' A' ' 135' ' ' LEU . 19.4 mmt85 -56.22 -40.83 74.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.805 0.336 . . . . 0.0 110.509 179.602 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.0 tpp -59.96 -43.4 95.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.272 179.291 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.94 -40.29 97.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.679 179.517 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -62.25 -44.24 96.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.685 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 78.0 mtp180 -57.6 -43.9 85.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.619 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 186' ' ' ARG . 43.0 mmm-85 -62.33 -42.26 99.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.96 93.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.036 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 86.0 mt -61.73 -45.81 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.123 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 189' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -60.39 -41.87 94.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.082 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.25 -47.62 81.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.543 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -63.67 -59.74 4.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.93 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -95.52 118.4 32.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.87 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.64 49.7 1.86 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.517 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -71.39 134.21 46.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.845 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -66.21 -48.8 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.805 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.73 140.88 51.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.637 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.75 136.3 55.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.276 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -60.17 136.26 91.13 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.055 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo . . . . . 0 C--O 1.249 1.036 0 C-N-CA 122.547 2.165 . . . . 0.0 112.238 -179.976 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.465 -0.254 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.694 ' O ' HD12 ' A' ' 120' ' ' ILE . 2.0 pp -60.78 138.13 93.39 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.734 179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.439 ' HB2' ' H ' ' A' ' 122' ' ' ALA . 73.2 Cg_endo -75.45 -142.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.539 2.159 . . . . 0.0 111.631 179.723 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.439 ' H ' ' HB2' ' A' ' 121' ' ' PRO . . . -82.3 34.0 0.41 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.953 0.406 . . . . 0.0 110.616 179.197 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 123' ' ' THR . . . . . 0.649 HG23 ' OD1' ' A' ' 124' ' ' ASN . 3.7 t -78.37 -39.41 39.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.64 -179.833 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.649 ' OD1' HG23 ' A' ' 123' ' ' THR . 15.2 p-10 -161.22 36.12 0.14 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.75 HD12 ' N ' ' A' ' 126' ' ' SER . 4.4 pp -80.1 -35.54 36.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.44 179.264 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 126' ' ' SER . . . . . 0.75 ' N ' HD12 ' A' ' 125' ' ' LEU . 79.5 p -67.59 -39.93 84.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.086 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.409 ' HG2' HH11 ' A' ' 127' ' ' ARG . 15.2 tpp85 -56.27 -59.86 4.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.119 -179.683 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.8 -41.29 75.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.772 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.24 74.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.332 179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.847 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.86 -57.79 15.88 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.132 179.652 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.857 HD23 HD12 ' A' ' 184' ' ' LEU . 6.8 mp -53.63 -46.12 70.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -58.05 -55.0 40.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.681 0.277 . . . . 0.0 111.478 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.847 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.3 pttp -60.79 -34.16 74.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.895 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.797 ' HB3' HD13 ' A' ' 180' ' ' ILE . 45.3 mm-40 -60.64 -50.21 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.247 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.6 mm? -55.61 -43.5 76.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.843 0.354 . . . . 0.0 111.094 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.99 79.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 137' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 133' ' ' LYS . 68.5 mt -63.16 -42.53 96.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.581 -179.682 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.716 ' HB3' HD11 ' A' ' 177' ' ' ILE . 69.0 mm-40 -59.09 -44.88 91.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.43 -179.601 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.3 mt -60.32 -40.71 91.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.773 0.32 . . . . 0.0 111.001 -179.873 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -62.11 -50.13 73.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.493 -179.795 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.75 -49.96 64.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.993 -179.34 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.9 tttt -57.57 -44.86 85.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.338 -179.433 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -57.87 -51.21 70.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.496 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.39 -34.83 86.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.542 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.23 -40.95 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.983 0.42 . . . . 0.0 110.421 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -60.71 -43.72 97.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.743 179.706 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.23 -43.37 98.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.933 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 84.1 mtp -63.33 -47.26 82.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.965 179.899 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.1 mt -56.68 -47.95 81.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -65.12 -40.03 93.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.039 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.4 m -56.87 -46.03 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.627 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.494 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.9 m-85 -71.76 -39.77 69.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.341 -179.726 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 67.0 p -77.12 40.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.913 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -178.57 -51.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.927 0.394 . . . . 0.0 110.64 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -65.74 155.58 50.03 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.324 179.645 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -49.89 -42.94 48.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.826 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 86.0 m -63.49 130.41 44.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.733 179.599 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -150.91 46.01 0.84 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 159' ' ' ASP . . . . . 0.536 ' HB3' ' HB2' ' A' ' 162' ' ' LEU . 64.1 t0 -59.81 132.36 53.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.287 179.876 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.543 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 30.0 tpt180 -66.9 -50.16 63.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.752 -179.135 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.9 -46.22 82.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.945 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 162' ' ' LEU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 159' ' ' ASP . 77.3 mt -61.17 -45.85 92.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.226 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 152' ' ' TYR . 57.3 tp -60.33 -45.65 92.68 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.0 -0.28 . . . . 0.0 111.119 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 164' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 168' ' ' GLN . 94.8 mt -57.27 -37.26 72.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.774 0.321 . . . . 0.0 110.712 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 165' ' ' THR . . . . . 0.48 ' O ' ' HG3' ' A' ' 169' ' ' MET . 88.4 m -61.81 -47.52 84.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.163 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 166' ' ' ALA . . . . . 0.405 ' HB2' ' HE2' ' A' ' 148' ' ' MET . . . -68.15 -49.18 62.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.446 -179.902 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.413 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 25.9 mt-30 -56.96 -36.4 70.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 109.989 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 168' ' ' GLN . . . . . 0.558 ' HB2' ' O ' ' A' ' 164' ' ' LEU . 0.5 OUTLIER -62.21 -45.91 91.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.997 179.63 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 169' ' ' MET . . . . . 0.48 ' HG3' ' O ' ' A' ' 165' ' ' THR . 58.8 mtm -60.48 -39.33 87.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.9 tm? -60.77 -42.04 96.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.437 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 171' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 12.0 mm100 -64.96 -47.52 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.524 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -64.08 -42.27 97.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.816 -179.356 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.526 ' O ' HG13 ' A' ' 177' ' ' ILE . 86.2 p -57.83 -47.53 82.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.33 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -60.92 -48.01 83.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.607 -179.627 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.7 m -58.04 -48.6 79.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.707 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.486 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 54.6 mtmt -59.28 -43.64 92.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.047 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.716 HD11 ' HB3' ' A' ' 138' ' ' GLU . 72.2 mt -60.9 -35.57 65.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.183 179.919 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 178' ' ' ASP . . . . . 0.551 ' O ' ' HG2' ' A' ' 182' ' ' MET . 65.2 m-20 -62.25 -49.82 74.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.686 0.279 . . . . 0.0 110.806 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 39.9 mm -62.42 -50.17 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.038 0.447 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.797 HD13 ' HB3' ' A' ' 134' ' ' GLN . 88.4 mt -55.37 -49.92 69.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.277 179.555 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.718 ' HA ' HD13 ' A' ' 184' ' ' LEU . 79.5 ttt180 -49.47 -40.27 36.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.348 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.4 mmt -57.8 -41.06 81.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.867 178.951 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 183' ' ' GLN . . . . . 0.548 ' CB ' HD21 ' A' ' 131' ' ' LEU . 85.2 mt-30 -66.62 -36.91 83.73 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.057 179.482 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.857 HD12 HD23 ' A' ' 131' ' ' LEU . 6.8 mp -61.29 -56.95 14.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.728 0.299 . . . . 0.0 111.28 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.497 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 15.0 ptp180 -60.47 -43.23 97.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.747 -179.189 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 186' ' ' ARG . 15.0 tpp85 -60.12 -44.97 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.803 0.335 . . . . 0.0 110.987 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.18 -43.98 93.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.479 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 188' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 84.3 mt -64.13 -46.59 83.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.664 -179.421 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 87.5 mt-30 -56.81 -41.56 77.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.64 0.257 . . . . 0.0 111.436 -179.705 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -70.12 -56.51 6.69 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -75.86 -60.91 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.693 -179.043 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 188' ' ' LEU . 41.0 tt0 -68.44 140.66 55.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.187 -179.726 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 60.5 tp -172.13 130.84 0.62 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.309 179.744 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -57.63 -54.44 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.054 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 44.4 t30 -178.99 132.04 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.942 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -67.49 134.48 51.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.01 132.07 50.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.179 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 198' ' ' ALA . . . . . 0.549 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -174.52 54.68 0.15 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.273 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 199' ' ' PRO . . . . . 0.549 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 35.2 Cg_exo . . . . . 0 C--O 1.248 1.0 0 C-N-CA 122.413 2.075 . . . . 0.0 112.266 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.396 -0.281 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 120' ' ' ILE . . . . . 0.464 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 67.5 mt 64.55 132.91 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.25 0 CA-C-O 120.696 0.284 . . . . 0.0 111.168 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 121' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 26.6 Cg_exo -62.84 -135.9 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.723 2.282 . . . . 0.0 112.478 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.67 47.17 0.15 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.843 0.354 . . . . 0.0 111.043 -179.938 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 70.2 p -134.85 40.74 2.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -174.5 35.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.545 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.571 ' O ' HD13 ' A' ' 125' ' ' LEU . 2.9 tm? -68.56 -40.9 80.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.332 179.924 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.6 p -53.13 -43.5 66.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.15 -179.926 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 127' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 20.7 ttm105 -63.18 -43.79 97.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.761 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.471 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 60.7 t -58.55 -45.94 90.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.995 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 179.734 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.718 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -62.09 -40.61 99.17 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.333 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 89.0 mt -67.34 -42.75 83.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.898 0.38 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 67.7 mm-40 -63.79 -46.8 83.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.75 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.718 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -59.98 -41.19 91.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.661 0.267 . . . . 0.0 111.229 -179.316 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 134' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 30.8 mm100 -59.32 -46.24 89.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 135' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 60.0 tp -61.42 -41.93 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.844 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.88 85.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.285 -179.763 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -59.15 -42.41 86.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.708 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 138' ' ' GLU . . . . . 0.662 ' HB3' HD11 ' A' ' 177' ' ' ILE . 65.0 mm-40 -61.97 -40.05 94.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.129 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.6 mt -59.8 -42.4 93.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.209 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.83 -49.19 71.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.189 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.68 -46.93 93.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.166 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 142' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.8 tttm -61.88 -44.16 97.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.629 179.961 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -58.69 -44.84 90.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.06 179.675 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 144' ' ' GLY . . . . . 0.465 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -65.16 -35.08 91.27 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 145' ' ' ALA . . . . . 0.536 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.58 -41.09 89.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.542 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.0 mt-10 -61.72 -42.54 99.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.687 179.722 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -61.99 -39.44 92.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.523 179.591 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 148' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.8 mtp -67.81 -41.49 83.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.274 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 149' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 145' ' ' ALA . 73.5 mt -63.33 -47.5 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.439 -179.564 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 150' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 3.1 pt20 -68.83 -45.36 71.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.768 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 151' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 153' ' ' SER . 93.2 m -66.04 -48.35 71.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.873 -179.377 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 152' ' ' TYR . . . . . 0.492 ' O ' HD13 ' A' ' 163' ' ' LEU . 1.4 m-85 -74.47 23.1 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.832 -179.518 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 153' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 151' ' ' THR . 37.4 t -166.06 66.98 0.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.645 0.259 . . . . 0.0 111.189 -179.724 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -160.01 -54.67 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.622 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 167.26 56.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 -179.709 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -160.39 -44.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.806 0.336 . . . . 0.0 111.082 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 15.3 t -68.83 -150.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.829 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -176.65 -47.28 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.77 0.319 . . . . 0.0 110.777 179.714 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -75.54 120.38 20.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 179.662 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 48.9 mmt-85 -74.15 -30.71 62.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.998 179.44 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -53.24 -46.78 69.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.75 -40.33 96.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.059 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 163' ' ' LEU . . . . . 0.492 HD13 ' O ' ' A' ' 152' ' ' TYR . 62.3 tp -57.43 -48.02 80.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.832 0.348 . . . . 0.0 110.578 179.739 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.9 -39.63 94.62 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.166 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.8 m -56.47 -44.61 80.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.658 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.44 -41.3 98.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 167' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.2 mt-30 -58.03 -42.53 85.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.153 179.61 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -59.36 -40.03 85.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.768 179.119 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.1 mtp -59.92 -47.31 86.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.634 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 170' ' ' LEU . . . . . 0.489 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.1 tm? -57.4 -47.49 81.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.675 -179.754 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -60.59 -42.04 95.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -57.46 -46.41 83.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 173' ' ' SER . . . . . 0.512 ' O ' HG13 ' A' ' 177' ' ' ILE . 51.1 m -62.09 -42.97 99.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 -179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 174' ' ' LYS . . . . . 0.577 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.54 -42.99 84.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.492 -179.723 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.7 m -61.37 -48.73 79.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.406 -179.634 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 176' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 180' ' ' ILE . 68.3 mttm -62.87 -46.59 87.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.196 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 177' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' A' ' 138' ' ' GLU . 54.6 mt -59.99 -40.23 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.138 -179.776 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 178' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 182' ' ' MET . 8.2 t70 -58.03 -44.67 87.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.001 0.429 . . . . 0.0 109.99 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.99 -43.05 97.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.926 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 71.3 mt -59.88 -46.78 93.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.129 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 73.1 mtt-85 -55.48 -44.2 76.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 182' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 92.2 mmm -59.69 -37.5 78.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.491 179.577 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -67.34 -38.93 85.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.089 179.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 184' ' ' LEU . . . . . 0.48 HD22 HD13 ' A' ' 131' ' ' LEU . 9.2 mt -60.49 -53.95 51.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.179 0.514 . . . . 0.0 110.768 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 185' ' ' ARG . . . . . 0.534 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 7.7 ptm180 -64.2 -43.02 96.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.179 -179.879 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 186' ' ' ARG . . . . . 0.455 ' HA ' ' OE1' ' A' ' 189' ' ' GLN . 46.1 ttm-85 -62.3 -36.11 81.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.129 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -65.78 -43.62 88.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.682 -179.59 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 81.9 mt -65.73 -49.32 68.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.878 -179.2 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 189' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 9.4 pt20 -59.5 -47.49 85.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.858 0.361 . . . . 0.0 111.644 -179.601 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -67.0 -39.21 87.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.612 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.62 -32.64 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.114 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 192' ' ' GLN . . . . . 0.443 ' HG2' ' N ' ' A' ' 193' ' ' LEU . 64.0 tt0 -157.05 -116.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.471 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 193' ' ' LEU . . . . . 0.443 ' N ' ' HG2' ' A' ' 192' ' ' GLN . 60.8 tp 68.08 -65.22 0.26 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.651 0.38 . . . . 0.0 111.994 179.77 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 65.96 129.14 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.85 0.357 . . . . 0.0 111.128 -179.7 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 46.3 t30 63.67 125.73 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.133 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.07 139.95 45.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.248 179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.81 142.51 57.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.486 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 65.78 138.5 0.05 OUTLIER Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.494 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo . . . . . 0 C--O 1.25 1.087 0 C-N-CA 122.471 2.114 . . . . 0.0 112.287 -179.933 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 . . . . . 0 N--CA 1.457 -0.087 0 CA-C-O 120.921 0.391 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 84.3 t -61.2 -45.7 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.58 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.98 -43.88 97.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.47 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.71 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -60.85 -50.67 65.01 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.01 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.469 HD13 HD22 ' A' ' 184' ' ' LEU . 93.4 mt -67.26 -40.2 86.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.82 0.343 . . . . 0.0 111.427 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -62.67 -47.15 84.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.575 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.71 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.8 pttt -60.85 -41.64 96.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.598 0.237 . . . . 0.0 111.116 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.6 HE21 ' HE3' ' A' ' 133' ' ' LYS . 98.7 mm-40 -57.42 -44.66 84.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.901 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -61.31 -41.83 97.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.403 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.46 -45.71 90.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.23 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.2 -41.32 83.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.908 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.526 ' HB3' ' CD1' ' A' ' 177' ' ' ILE . 62.1 mm-40 -57.95 -44.28 86.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.015 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.5 mt -61.3 -39.5 90.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.225 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -62.2 -47.84 82.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.5 t -72.53 -48.31 47.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.0 tttp -60.29 -54.98 39.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.158 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -61.79 -38.8 89.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.34 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.57 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.95 -40.83 98.97 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.503 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.98 -42.11 81.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 110.568 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 49.7 mt-10 -62.5 -42.32 99.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.507 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 45.2 t30 -60.61 -40.18 90.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.776 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.3 mmm -67.93 -45.25 74.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.021 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.6 mt -57.09 -49.72 78.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.659 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.507 ' NE2' ' HA ' ' A' ' 147' ' ' ASN . 15.1 pt20 -63.59 -41.33 98.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.411 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 95.1 m -60.14 -44.5 94.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 162' ' ' LEU . 7.3 m-30 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 39.4 ttpt . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.976 0.417 . . . . 0.0 110.571 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.552 ' HB3' ' CE2' ' A' ' 152' ' ' TYR . 4.5 mm? -67.02 -34.82 78.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.108 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.0 tp -56.13 -54.18 48.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.381 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.636 HD12 ' N ' ' A' ' 165' ' ' THR . 4.3 pp -64.29 -38.49 91.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.782 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.636 ' N ' HD12 ' A' ' 164' ' ' LEU . 84.9 m -55.63 -46.02 77.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.961 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.61 94.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 73.7 mt-30 -56.35 -46.42 79.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.572 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -62.55 -41.15 98.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.044 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 73.5 mtp -57.44 -47.94 80.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.519 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.44 -44.17 97.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.624 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.895 ' HA ' ' HE3' ' A' ' 174' ' ' LYS . 85.7 mt-30 -59.07 -49.49 77.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -66.98 -41.09 87.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.784 0.326 . . . . 0.0 111.321 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.62 ' O ' HG13 ' A' ' 177' ' ' ILE . 58.2 m -62.42 -50.84 69.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.026 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.895 ' HE3' ' HA ' ' A' ' 171' ' ' GLN . 22.0 pttp -60.29 -40.09 89.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . 0.509 ' O ' HG13 ' A' ' 179' ' ' ILE . 85.0 m -58.18 -47.55 83.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.045 0.45 . . . . 0.0 111.057 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.04 -34.9 77.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 173' ' ' SER . 21.7 mt -60.66 -49.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.713 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -59.94 -36.43 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 110.227 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 175' ' ' THR . 61.4 mt -61.96 -48.37 88.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.475 HD13 ' HB3' ' A' ' 134' ' ' GLN . 68.0 mt -61.93 -41.08 89.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -55.31 -43.86 75.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.444 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.7 ttm -60.91 -41.04 95.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.185 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -59.23 -40.67 86.61 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 131' ' ' LEU . 11.9 mt -58.23 -54.67 44.32 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.712 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 185' ' ' ARG . 47.9 mtp85 -54.75 -41.98 71.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.39 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.409 HH11 ' HG2' ' A' ' 186' ' ' ARG . 53.7 ttt-85 -62.8 -34.65 77.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.712 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.128 -179.909 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.445 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 99.8 mtt180 . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.737 0.303 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.3 t -56.98 -51.87 63.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.375 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.25 -40.79 97.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.114 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.833 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.39 -43.97 98.65 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.522 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 184' ' ' LEU . 93.3 mt -67.5 -41.18 84.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.779 0.323 . . . . 0.0 111.197 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.2 mm-40 -63.73 -48.58 76.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.77 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.833 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.9 pttt -59.53 -41.53 90.23 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.014 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.67 -39.33 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.958 0.409 . . . . 0.0 110.686 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.589 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.6 tm? -58.95 -41.74 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.392 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.92 89.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.157 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.477 ' O ' HG23 ' A' ' 141' ' ' VAL . 68.7 mt -65.39 -48.04 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.194 -179.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 12.2 pt-20 -59.1 -45.4 90.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.375 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.98 -39.04 90.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.626 0.251 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -60.45 -44.29 95.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.209 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.0 t -66.26 -46.97 85.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.577 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.529 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 40.3 ttmt -61.63 -46.81 88.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.276 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -62.69 -48.91 77.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.641 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.52 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.55 -34.62 86.63 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.753 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.87 -44.64 76.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.873 0.368 . . . . 0.0 110.348 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 51.7 mt-10 -60.15 -41.78 93.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.87 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.428 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 20.1 t-20 -59.04 -43.77 91.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.341 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.523 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.8 mmm -67.5 -45.37 76.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.6 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.599 HG13 ' O ' ' A' ' 145' ' ' ALA . 89.6 mt -52.88 -53.77 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.407 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 147' ' ' ASN . 3.0 pt20 -58.99 -36.55 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.033 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 54.9 m -54.93 -54.96 36.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.862 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.605 ' HB2' HD13 ' A' ' 163' ' ' LEU . 37.1 m-85 . . . . . 0 C--N 1.326 -0.416 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.642 -179.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt . . . . . 0 C--O 1.234 0.283 0 CA-C-O 121.036 0.446 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 98.8 mt -61.02 -36.39 79.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.004 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.605 HD13 ' HB2' ' A' ' 152' ' ' TYR . 39.9 tp -57.37 -46.42 83.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.104 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.54 -42.75 75.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.417 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.568 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.7 m -57.19 -42.74 81.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.819 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -71.0 -35.83 72.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.297 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 13.0 mm-40 -56.92 -48.82 77.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.991 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 165' ' ' THR . 19.4 pt20 -65.45 -41.37 93.49 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.162 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.8 mtm -59.51 -38.18 80.26 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-O 120.865 0.364 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.6 -45.43 94.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -59.8 -50.85 72.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.17 -39.55 93.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 43.1 t -56.86 -44.75 82.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.82 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 55.9 mtpt -61.06 -44.54 97.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.625 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -56.03 -41.69 75.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.88 -45.52 93.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.05 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.546 HG12 ' CD ' ' A' ' 138' ' ' GLU . 28.5 mt -57.85 -41.78 80.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.942 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.59 -49.31 73.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.754 0.311 . . . . 0.0 111.435 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 64.6 mt -62.12 -50.29 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.32 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -59.13 -43.97 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -53.55 -41.09 66.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.273 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.429 ' SD ' ' HD3' ' A' ' 185' ' ' ARG . 48.0 tpp -62.62 -38.24 89.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.306 179.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.69 -44.09 94.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.259 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -58.36 -55.27 37.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.429 ' HD3' ' SD ' ' A' ' 182' ' ' MET . 16.0 ptm180 -58.85 -38.63 79.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.727 0.299 . . . . 0.0 110.594 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -57.74 -40.45 79.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.739 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.867 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.488 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 6.5 tpm_? . . . . . 0 CA--C 1.529 0.152 0 CA-C-O 120.641 0.258 . . . . 0.0 111.511 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 89.6 t -63.53 -52.57 56.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.898 0.38 . . . . 0.0 111.54 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.77 85.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.505 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.552 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.41 -44.42 97.64 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.572 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 184' ' ' LEU . 94.8 mt -67.88 -41.0 83.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.851 0.358 . . . . 0.0 111.074 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 95.3 mt-10 -64.18 -49.19 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.537 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.463 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -57.2 -39.48 75.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.765 0.317 . . . . 0.0 110.608 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 95.0 mm-40 -58.29 -46.07 86.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.562 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 95.5 mt -54.62 -44.48 73.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.03 99.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.345 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.9 mt -59.74 -48.82 86.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.317 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.428 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.0 OUTLIER -55.67 -45.38 77.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.694 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 48.0 mt -62.35 -38.51 89.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -63.01 -42.81 99.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 0.0 110.479 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.69 -46.36 82.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.208 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.739 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 38.9 ttmt -61.01 -49.47 77.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -62.34 -43.55 98.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.449 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.68 -36.26 89.03 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.883 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.524 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.17 -41.77 80.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.96 0.409 . . . . 0.0 110.568 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.4 mt-10 -60.06 -44.57 94.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.999 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.544 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 19.3 t-20 -61.8 -44.86 96.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.554 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.5 mtp -61.0 -40.76 94.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 145' ' ' ALA . 85.3 mt -61.21 -51.07 77.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 147' ' ' ASN . 4.0 pp0? -66.85 -30.47 70.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.713 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.7 m -64.59 -50.61 66.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.86 179.807 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . 0.525 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 8.4 ptpp? . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.751 0.31 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.95 -35.92 72.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.819 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.501 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -57.03 -51.26 69.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.094 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 165' ' ' THR . 4.2 pp -65.03 -38.52 91.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.627 ' N ' HD12 ' A' ' 164' ' ' LEU . 89.7 m -55.63 -45.19 77.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.46 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -63.71 -40.68 97.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.325 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.6 mt-30 -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.934 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -60.69 -41.28 94.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.96 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.6 mtp -59.71 -47.48 85.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.477 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.546 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 60.7 tp -57.03 -44.47 82.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.564 ' HA ' ' NZ ' ' A' ' 174' ' ' LYS . 8.3 tt0 -61.64 -43.14 99.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.081 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.41 -43.93 96.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.417 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.5 ' O ' HG13 ' A' ' 177' ' ' ILE . 89.3 p -62.29 -45.58 92.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.435 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.739 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 10.4 mtmp? -57.66 -49.64 75.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.6 m -55.73 -43.34 76.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.282 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.93 -41.01 97.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.072 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 173' ' ' SER . 64.1 mt -58.48 -41.07 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.025 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.6 -46.15 83.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.184 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 182' ' ' MET . 51.0 mm -62.93 -43.87 99.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.08 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.6 ' O ' HD23 ' A' ' 184' ' ' LEU . 72.9 mt -65.64 -40.73 88.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 110.501 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.507 ' HE ' ' NH2' ' A' ' 185' ' ' ARG . 78.4 ttt180 -52.06 -52.11 53.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.393 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 21.2 ptp -62.79 -39.77 95.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 86.4 mt-30 -55.27 -43.88 75.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.717 0.294 . . . . 0.0 110.483 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.4 mm? -61.53 -39.28 90.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.507 ' NH2' ' HE ' ' A' ' 181' ' ' ARG . 21.5 mmt85 -55.85 -58.16 9.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.417 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.439 HH11 ' HG2' ' A' ' 186' ' ' ARG . 0.6 OUTLIER -67.23 -32.78 74.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.406 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 111.044 -179.907 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 15.5 tpp85 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.717 0.294 . . . . 0.0 111.316 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.1 t -61.85 -54.85 29.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.363 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.83 -38.07 86.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.104 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.601 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.23 -45.27 96.38 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.524 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.58 ' HB3' HD21 ' A' ' 184' ' ' LEU . 93.3 mt -67.88 -43.9 78.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.709 0.29 . . . . 0.0 111.155 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 58.4 mm-40 -60.11 -48.27 82.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.672 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -60.19 -40.81 91.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.179 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.8 mm100 -56.68 -45.01 82.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.692 0.282 . . . . 0.0 110.923 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.9 tp -60.12 -42.73 95.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.893 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.74 96.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.8 mt -59.47 -42.3 87.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.8 mm-40 -58.59 -43.98 89.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.2 mt -60.11 -38.26 82.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.498 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 13.0 tmtt? -63.59 -52.85 59.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.228 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.1 -45.27 87.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.748 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.423 ' HE2' ' HD3' ' A' ' 174' ' ' LYS . 62.8 tttm -58.05 -45.77 86.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.056 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -64.06 -47.91 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.195 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.31 -32.16 79.8 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.822 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.644 ' O ' HG12 ' A' ' 149' ' ' ILE . . . -66.17 -43.99 85.32 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.105 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.6 mt-10 -58.96 -40.83 85.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.343 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -58.5 -42.63 88.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 83.5 mtp -66.4 -45.85 78.6 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.604 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 145' ' ' ALA . 43.0 mm -54.65 -42.91 63.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.688 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -41.78 65.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 67.2 m -56.71 -52.86 63.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.86 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.942 -179.225 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.794 0.33 . . . . 0.0 111.234 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.408 HD22 ' N ' ' A' ' 162' ' ' LEU . 3.8 mm? -70.07 -35.61 74.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.112 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.1 tp -54.66 -49.2 71.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.858 0.361 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.9 mt -67.04 -35.8 80.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.38 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.6 m -57.59 -47.85 81.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.257 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.56 -46.54 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.089 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 85.4 mt-30 -56.8 -36.99 70.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.154 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.2 tp60 -64.24 -44.24 92.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.821 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 165' ' ' THR . 39.1 mtm -63.2 -42.39 99.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.424 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 49.1 tp -61.22 -46.23 91.3 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -61.09 -44.5 97.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.287 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -57.74 -43.26 85.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.848 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.555 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.0 m -63.13 -43.32 98.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.061 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.4 mmmm -56.07 -51.91 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.516 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.3 m -56.41 -45.87 80.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.679 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 180' ' ' ILE . 34.4 mmtp -62.84 -41.81 99.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.487 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.657 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -59.99 -40.16 82.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.355 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.6 -46.06 90.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.681 ' O ' ' HG3' ' A' ' 182' ' ' MET . 67.0 mt -63.22 -44.15 99.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.928 0.394 . . . . 0.0 110.761 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.579 ' O ' HD23 ' A' ' 184' ' ' LEU . 69.7 mt -63.99 -38.2 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.897 0.38 . . . . 0.0 110.369 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 181' ' ' ARG . 40.3 ttt85 -54.93 -49.27 71.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.251 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 4.5 ppp? -65.54 -32.9 74.74 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.564 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 73.3 mt-30 -61.03 -47.25 87.28 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.851 0.357 . . . . 0.0 110.576 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.58 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -60.19 -43.92 95.5 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.669 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 185' ' ' ARG . 48.3 mtp85 -54.44 -44.19 72.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.601 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -63.79 -36.21 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.917 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.018 -179.923 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.419 ' HG2' HH11 ' A' ' 127' ' ' ARG . 55.1 ttp85 . . . . . 0 N--CA 1.458 -0.048 0 CA-C-O 120.779 0.323 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 72.6 t -47.51 -48.71 10.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.532 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.06 -37.23 81.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.583 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -60.2 -58.18 15.34 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.538 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 1.017 HD23 HD22 ' A' ' 184' ' ' LEU . 7.0 mp -53.25 -43.31 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.681 0.277 . . . . 0.0 111.71 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.3 mt-10 -64.36 -50.53 67.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 23.2 pttm -59.94 -37.92 80.92 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.1 mm100 -59.22 -48.79 80.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.296 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 88.0 mt -57.64 -44.14 85.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.636 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -60.93 -49.7 76.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.056 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.83 -48.75 86.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.963 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.582 ' OE2' HD11 ' A' ' 180' ' ' ILE . 0.3 OUTLIER -59.33 -45.4 91.45 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.325 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 86.7 mt -58.66 -41.47 86.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 62.1 mttp -61.81 -49.71 75.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.378 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.36 -46.67 83.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 111.382 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.8 tttt -57.25 -47.35 81.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.051 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -59.07 -42.65 90.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.04 -37.65 94.9 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.188 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 170' ' ' LEU . . . -66.27 -41.17 90.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.1 0.476 . . . . 0.0 110.243 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -63.33 -39.35 94.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.44 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.32 -44.61 88.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.429 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 18.7 mmt -63.64 -48.33 77.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.142 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 145' ' ' ALA . 69.6 mt -55.19 -45.43 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 0.0 111.086 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.99 -39.7 90.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.091 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.5 m -65.37 -52.32 54.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.708 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 148' ' ' MET . 10.0 m-85 . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.608 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.2 tptt . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.708 0.29 . . . . 0.0 111.325 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.195 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.468 ' HG ' HE21 ' A' ' 167' ' ' GLN . 63.3 tp -55.66 -52.55 63.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.886 0.374 . . . . 0.0 110.464 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 87.3 mt -69.56 -37.14 76.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.491 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.45 ' O ' ' HG3' ' A' ' 169' ' ' MET . 94.6 m -55.52 -44.66 76.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.841 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.49 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.564 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.468 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.3 mt-30 -58.29 -38.11 76.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.149 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 94.5 mm-40 -63.62 -42.72 98.15 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.037 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.6 mtm -64.17 -40.43 96.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 49.3 tp -62.55 -42.88 99.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.984 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -58.79 -45.39 89.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.767 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -60.61 -41.46 94.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.727 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.7 m -62.05 -42.35 99.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.945 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.7 mtpp -57.91 -44.38 86.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.004 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 92.2 m -61.0 -46.11 92.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.0 mtpp -59.89 -47.87 84.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.853 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 180' ' ' ILE . 64.7 mt -60.23 -35.77 64.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.962 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 181' ' ' ARG . 30.4 t70 -57.72 -49.41 76.63 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.404 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 42.3 mm -60.65 -39.29 81.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.4 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.777 HD12 ' HA ' ' A' ' 177' ' ' ILE . 66.2 mt -56.39 -53.67 37.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.603 HH11 HG22 ' A' ' 177' ' ' ILE . 78.3 mtm-85 -52.38 -39.38 60.74 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.487 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 64.9 mtt -57.87 -40.2 79.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.434 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -70.37 -41.74 72.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.222 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 1.017 HD22 HD23 ' A' ' 131' ' ' LEU . 4.4 mm? -61.11 -51.71 67.94 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.504 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 16.9 ptm180 -59.29 -45.09 92.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -63.72 -35.75 81.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.098 0.475 . . . . 0.0 110.565 179.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.36 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.324 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.41 HH11 ' HG3' ' A' ' 127' ' ' ARG . 62.2 mtm-85 . . . . . 0 C--O 1.231 0.128 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.46 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 96.2 t -65.34 -48.82 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.294 . . . . 0.0 111.773 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.6 83.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.325 -179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.58 -46.03 95.12 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.535 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 184' ' ' LEU . 82.8 mt -65.61 -43.67 88.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.828 0.347 . . . . 0.0 111.093 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -60.64 -50.84 71.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.867 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 22.1 ptmt -57.93 -38.82 76.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.559 0.218 . . . . 0.0 110.907 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.0 mm-40 -57.92 -45.33 86.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.803 0.335 . . . . 0.0 110.66 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.519 ' HA ' ' CD ' ' A' ' 138' ' ' GLU . 60.5 tp -60.27 -38.34 83.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.271 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.6 80.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.07 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.8 mt -64.57 -49.09 82.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.677 ' OE1' HG13 ' A' ' 180' ' ' ILE . 7.6 pt-20 -57.89 -44.8 86.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.1 mt -59.89 -42.17 93.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.752 0.311 . . . . 0.0 110.943 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -59.39 -45.26 91.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.02 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.3 t -65.86 -45.94 90.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.667 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 40.2 ttmt -60.16 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.679 0.276 . . . . 0.0 111.107 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.31 -43.4 98.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.856 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.2 -37.86 94.68 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.335 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.37 -42.88 82.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 110.417 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.48 -41.22 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.736 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -58.07 -45.66 86.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.613 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 92.0 mmm -65.6 -46.04 80.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 145' ' ' ALA . 87.4 mt -55.79 -46.24 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.181 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 72.9 mt-30 -62.16 -41.2 98.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.0 m -64.79 -37.74 88.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.584 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 C--N 1.327 -0.388 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.109 -179.311 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . 0.617 ' NZ ' ' HB2' ' A' ' 161' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.209 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.431 ' N ' ' HG3' ' A' ' 161' ' ' LYS . 60.7 tp -59.8 -43.41 94.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.494 0.188 . . . . 0.0 111.104 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 61.3 tp -59.11 -40.4 85.23 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.79 -42.71 72.11 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.065 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 93.2 m -57.42 -46.02 83.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.262 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.15 94.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.797 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 96.8 mm-40 -57.27 -47.27 81.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.407 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.42 -38.33 89.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.021 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 69.0 mmm -59.92 -46.52 89.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.284 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.509 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -56.48 -46.97 80.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.539 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -62.88 -42.64 99.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.917 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 48.7 m -58.22 -43.94 87.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.113 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.672 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 7.5 mtpm? -59.2 -44.22 92.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.739 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 179' ' ' ILE . 87.9 m -57.49 -43.53 84.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.574 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 7.9 mtpm? -56.99 -49.68 75.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.722 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.589 HD12 ' NZ ' ' A' ' 142' ' ' LYS . 56.4 mt -57.9 -41.08 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.184 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.09 -45.96 89.52 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.889 0.376 . . . . 0.0 110.586 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 175' ' ' THR . 51.2 mm -58.53 -39.68 76.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.384 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.677 HG13 ' OE1' ' A' ' 138' ' ' GLU . 46.9 mm -60.68 -47.32 93.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.855 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.0 tpt85 -52.9 -42.13 65.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.186 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -60.93 -42.32 97.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.554 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -61.1 -46.11 91.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.614 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -57.84 -42.27 84.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.868 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 51.2 mtp85 -59.9 -46.37 89.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.879 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 47.6 mtp85 -60.93 -37.76 83.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.083 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.689 0.281 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 82.7 t -61.03 -57.15 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.6 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.73 90.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.562 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.837 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.16 -47.67 89.84 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.909 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.56 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 82.8 mt -67.51 -41.34 84.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.666 0.27 . . . . 0.0 111.535 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -61.76 -47.65 84.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.776 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.837 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.8 pttt -60.08 -42.35 94.43 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.81 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HB3' HD13 ' A' ' 180' ' ' ILE . 97.7 mm-40 -61.04 -40.5 93.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.816 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.522 ' C ' HD13 ' A' ' 135' ' ' LEU . 3.4 tm? -58.62 -46.42 87.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.248 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . 0.506 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -66.79 -45.95 76.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.07 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.559 ' O ' HG23 ' A' ' 141' ' ' VAL . 71.2 mt -60.96 -48.62 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.65 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.3 pt-20 -59.78 -43.82 94.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.585 HD23 HD13 ' A' ' 177' ' ' ILE . 84.0 mt -59.29 -45.16 92.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.684 0.278 . . . . 0.0 110.984 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.602 ' HB3' ' NZ ' ' A' ' 140' ' ' LYS . 8.1 mtpm? -59.73 -42.91 94.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.933 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.6 t -62.41 -40.55 88.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.734 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.3 tttt -61.35 -49.04 78.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.97 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -61.43 -44.39 97.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.536 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.17 -38.42 95.58 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.638 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.51 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.47 -41.51 84.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.976 0.417 . . . . 0.0 110.765 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 96.2 mt-10 -59.53 -44.14 93.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.021 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.85 -44.42 97.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.547 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.536 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 91.9 mmm -64.3 -42.7 96.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.238 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.561 HD11 ' HA ' ' A' ' 167' ' ' GLN . 88.8 mt -62.63 -47.78 91.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 84.6 mt-30 -63.52 -44.94 92.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.182 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 94.5 m -62.5 -49.43 75.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.68 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.691 -179.57 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 22.0 pttp . . . . . 0 C--O 1.233 0.199 0 CA-C-O 120.77 0.319 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.416 ' N ' ' HG3' ' A' ' 161' ' ' LYS . 90.7 mt -64.53 -37.68 88.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.368 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 62.8 tp -58.51 -42.66 88.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.43 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.498 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 85.1 mt -63.05 -38.73 92.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.402 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.0 m -65.43 -41.74 93.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.888 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.91 -48.63 70.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.597 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.561 ' HA ' HD11 ' A' ' 149' ' ' ILE . 3.2 pt20 -58.24 -38.57 77.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.077 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -63.09 -39.98 96.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.827 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 68.5 mtp -61.58 -46.33 90.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.813 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.513 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 56.2 tp -57.02 -46.1 82.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.286 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -60.87 -46.8 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.22 -42.42 98.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.6 m -62.86 -49.74 73.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.429 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.9 mtpp -57.14 -43.24 82.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.011 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.1 m -59.01 -47.42 85.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.94 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.3 -40.21 81.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.585 HD13 HD23 ' A' ' 139' ' ' LEU . 53.0 mt -59.74 -39.78 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -62.47 -53.13 59.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.279 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -62.48 -56.15 19.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.084 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.65 HD12 ' OE1' ' A' ' 138' ' ' GLU . 68.0 mt -52.7 -40.24 33.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.627 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.587 ' HD3' HD12 ' A' ' 184' ' ' LEU . 15.6 tpp85 -54.77 -43.95 73.23 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.984 0.421 . . . . 0.0 110.081 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 91.2 mmm -57.32 -43.7 83.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.458 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -67.32 -32.27 73.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.276 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.587 HD12 ' HD3' ' A' ' 181' ' ' ARG . 20.7 mt -57.09 -57.13 13.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.252 0.549 . . . . 0.0 110.663 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -62.6 -41.57 99.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.549 ' HD2' ' O ' ' A' ' 186' ' ' ARG . 4.7 tmm_? -59.22 -40.27 85.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.371 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.565 -179.705 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.576 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 5.5 tpm_? . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.745 0.307 . . . . 0.0 111.475 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.2 t -65.49 -51.51 62.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.51 93.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.921 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.79 -49.67 66.7 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.827 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 184' ' ' LEU . 98.1 mt -65.74 -44.85 84.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.831 0.348 . . . . 0.0 111.083 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -56.81 -50.8 71.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.627 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 15.0 ptmm? -58.71 -36.63 74.56 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.414 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.715 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.5 mm100 -56.2 -45.22 79.9 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.509 179.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 4.5 mm? -58.74 -41.18 85.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.065 0.46 . . . . 0.0 110.485 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.1 89.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.935 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.7 mt -66.46 -49.53 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.127 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.494 ' OE2' ' HG ' ' A' ' 139' ' ' LEU . 1.4 pp20? -60.19 -43.32 96.0 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.464 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.494 ' HG ' ' OE2' ' A' ' 138' ' ' GLU . 93.1 mt -56.54 -45.31 81.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.82 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -62.39 -47.06 85.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 137' ' ' ILE . 61.5 t -64.93 -40.83 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.424 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.488 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 61.8 tttm -62.21 -50.21 72.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.173 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.01 -44.89 91.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.763 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.455 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -63.15 -34.78 90.89 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.534 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.07 -42.48 80.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.952 0.406 . . . . 0.0 110.799 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.4 mt-10 -60.7 -43.59 97.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -60.99 -41.36 96.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.455 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.2 mtp -64.66 -44.3 90.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 79.9 mt -58.64 -50.29 79.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.544 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -65.48 -39.97 92.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.502 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.8 m -57.4 -49.33 76.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.779 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.97 ' HB2' HD13 ' A' ' 163' ' ' LEU . 4.2 m-85 . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.708 0.29 . . . . 0.0 111.355 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.729 0.3 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.456 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 98.2 mt -62.91 -38.3 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.255 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.97 HD13 ' HB2' ' A' ' 152' ' ' TYR . 54.5 tp -58.12 -43.4 87.18 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.51 -42.49 92.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.529 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.7 m -59.06 -43.04 91.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.944 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.01 -44.16 97.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.489 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -57.74 -43.23 85.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.398 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -60.51 -38.02 83.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.048 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.6 mtp -62.11 -47.22 85.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.848 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.515 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -57.8 -48.55 79.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.006 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -43.53 98.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.013 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . 0.558 ' OD1' ' HE2' ' A' ' 176' ' ' LYS . 8.7 t70 -61.29 -43.58 98.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.092 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 177' ' ' ILE . 38.8 t -59.72 -46.17 89.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -57.93 -40.31 80.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.901 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 88.7 m -58.62 -45.93 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.558 ' HE2' ' OD1' ' A' ' 172' ' ' ASP . 68.0 mttm -61.07 -43.81 98.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 173' ' ' SER . 63.0 mt -55.61 -40.87 61.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.355 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -64.97 -48.62 73.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.073 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 43.4 mm -61.73 -47.19 94.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.715 HD13 ' HB3' ' A' ' 134' ' ' GLN . 74.8 mt -61.82 -40.58 87.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.001 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 181' ' ' ARG . 41.5 ttt85 -55.18 -44.75 75.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 43.9 tpp -61.23 -39.98 92.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.154 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -59.66 -41.01 89.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.709 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.491 HD23 HD13 ' A' ' 131' ' ' LEU . 8.2 mt -59.31 -43.99 92.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.226 0.536 . . . . 0.0 109.954 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.621 ' HA ' HH11 ' A' ' 185' ' ' ARG . 3.3 mmm180 -56.6 -41.87 77.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.218 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.95 -39.39 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.716 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.018 -179.926 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.551 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 4.0 mmp_? . . . . . 0 N--CA 1.461 0.107 0 CA-C-O 120.707 0.289 . . . . 0.0 111.537 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 59.8 t -58.64 -46.21 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.61 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.72 92.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.702 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.746 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -65.62 -44.98 91.68 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.117 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 184' ' ' LEU . 92.4 mt -65.61 -43.22 90.3 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.744 -0.268 . . . . 0.0 111.474 -179.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.8 mm-40 -64.39 -46.61 82.58 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.746 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 66.0 pttt -57.83 -41.12 81.65 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.771 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 13.2 mm100 -59.46 -43.27 93.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.692 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.3 tm? -60.43 -43.82 96.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.88 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.3 84.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.485 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.1 -40.93 76.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.615 ' HB3' HD11 ' A' ' 177' ' ' ILE . 63.2 mm-40 -61.67 -42.1 98.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.0 mt -59.16 -42.83 91.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.292 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.07 -47.75 83.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.732 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.7 t -71.28 -48.77 52.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -60.88 -52.21 66.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.5 -179.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.21 -46.44 88.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.832 0.349 . . . . 0.0 110.752 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.628 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -62.34 -34.84 90.52 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.149 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.89 -40.3 91.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.937 0.399 . . . . 0.0 110.211 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -59.84 -42.08 92.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.32 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.628 HD22 ' HA2' ' A' ' 144' ' ' GLY . 76.7 m-20 -59.99 -42.12 93.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.201 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 89.1 mmm -64.46 -42.66 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.63 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.3 mt -60.69 -50.46 80.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.472 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -66.13 -42.52 89.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.761 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -49.53 77.21 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.919 ' HB2' HD13 ' A' ' 163' ' ' LEU . 2.2 m-85 . . . . . 0 C--N 1.331 -0.237 0 CA-C-O 120.717 0.294 . . . . 0.0 111.706 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.776 0.322 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.562 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 97.2 mt -58.4 -39.02 78.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.437 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.919 HD13 ' HB2' ' A' ' 152' ' ' TYR . 30.8 tp -57.78 -46.86 83.98 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.068 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 93.2 mt -58.77 -41.72 87.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.938 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 86.8 m -61.12 -41.32 96.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.519 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.29 80.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.445 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -60.41 -45.47 93.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.133 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -62.5 -40.78 97.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.538 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.6 mmm -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.585 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 2.9 tm? -61.48 -44.32 97.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.3 -47.17 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.288 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 63.6 t0 -66.38 -40.95 90.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.191 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.5 m -62.12 -52.41 63.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.914 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.597 ' NZ ' ' HB2' ' A' ' 174' ' ' LYS . 0.0 OUTLIER -61.83 -41.65 98.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.506 -179.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 93.4 m -57.84 -48.53 79.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.795 0.331 . . . . 0.0 111.255 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.559 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 4.0 mmmp? -58.98 -40.25 84.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.615 HD11 ' HB3' ' A' ' 138' ' ' GLU . 40.0 mt -59.91 -38.63 77.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 181' ' ' ARG . 58.2 m-20 -60.86 -45.04 96.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 110.009 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 56.9 mt -59.59 -49.05 85.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.361 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.525 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -62.18 -36.42 74.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.606 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 185' ' ' ARG . 51.2 ttt-85 -52.39 -50.29 62.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.543 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 62.0 mtm -63.54 -38.75 92.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.871 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 24.5 mt-30 -56.72 -46.42 81.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.747 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -61.92 -42.12 98.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.002 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' A' ' 185' ' ' ARG . 3.7 mmp_? -52.42 -48.27 65.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.21 -35.32 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.459 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.221 0 CA-C-O 120.789 0.328 . . . . 0.0 111.171 -179.74 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 127' ' ' ARG . 54.2 ttp85 . . . . . 0 C--O 1.23 0.069 0 CA-C-O 120.858 0.361 . . . . 0.0 110.759 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.25 -48.25 85.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.579 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -61.5 -45.64 93.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.701 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.588 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -57.98 -48.73 80.69 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.989 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 184' ' ' LEU . 64.4 mt -68.34 -43.43 77.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.015 0.436 . . . . 0.0 111.05 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.75 -46.53 89.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 16.9 ptpt -61.71 -40.37 94.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.978 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -56.21 -45.83 79.72 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.8 0.333 . . . . 0.0 110.761 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 97.2 mt -58.91 -45.93 89.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.315 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.4 -47.76 80.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 133' ' ' LYS . 76.4 mt -56.56 -43.34 78.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.437 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.0 mm-40 -61.87 -41.79 98.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.158 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.2 mt -57.91 -39.95 79.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.859 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -62.69 -48.99 76.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.035 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 51.1 t -65.5 -42.49 93.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -59.69 -46.41 89.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.669 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -61.72 -47.23 86.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.538 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -59.97 -36.41 90.16 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.606 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.632 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -66.57 -41.52 88.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 110.501 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.675 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.538 HD22 ' HA2' ' A' ' 144' ' ' GLY . 78.7 m-20 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.654 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.483 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.0 mtp -70.57 -48.93 52.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.222 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.2 mt -53.83 -47.29 63.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.361 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -66.69 -38.17 86.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.316 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 55.6 m -61.56 -51.37 68.84 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.654 ' HB2' HD13 ' A' ' 163' ' ' LEU . 18.4 m-85 . . . . . 0 C--N 1.33 -0.264 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? . . . . . 0 C--O 1.233 0.186 0 CA-C-O 121.01 0.433 . . . . 0.0 110.11 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.11 -31.56 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.365 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.654 HD13 ' HB2' ' A' ' 152' ' ' TYR . 51.2 tp -57.91 -48.78 78.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.635 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.92 -44.84 91.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.821 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.1 m -60.96 -41.21 95.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.01 95.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.902 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.552 HE21 ' HG ' ' A' ' 163' ' ' LEU . 73.3 mt-30 -59.45 -40.04 85.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.101 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.622 ' HA ' HE21 ' A' ' 171' ' ' GLN . 53.3 tt0 -61.03 -39.39 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.357 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 67.2 mtp -66.16 -45.63 80.25 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.086 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 145' ' ' ALA . 2.9 tm? -57.38 -52.18 66.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.256 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.622 HE21 ' HA ' ' A' ' 168' ' ' GLN . 25.6 pt20 -64.18 -40.94 97.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.375 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -61.79 -44.13 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.898 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 177' ' ' ILE . 47.6 t -59.11 -45.57 90.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.046 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.69 -41.98 87.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.907 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.0 m -56.24 -47.13 79.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.969 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.524 ' O ' HG13 ' A' ' 180' ' ' ILE . 63.7 mttp -61.43 -39.8 92.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.576 ' O ' ' HG2' ' A' ' 181' ' ' ARG . 57.7 mt -62.72 -41.58 92.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.415 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -60.57 -51.44 69.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.368 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.445 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 34.1 pt -63.07 -40.02 87.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.512 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.56 HD13 ' HB3' ' A' ' 134' ' ' GLN . 62.4 mt -60.22 -45.34 96.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.59 0.233 . . . . 0.0 110.824 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 26.1 mmm180 -56.2 -44.13 79.17 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.324 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.762 ' HG3' HH21 ' A' ' 185' ' ' ARG . 45.8 ttm -59.36 -40.23 85.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.412 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 99.3 mm-40 -60.75 -38.28 84.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.269 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.749 HD22 HD13 ' A' ' 131' ' ' LEU . 8.3 mt -60.34 -43.67 96.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.227 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.762 HH21 ' HG3' ' A' ' 182' ' ' MET . 72.6 mtm180 -56.8 -46.3 81.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.176 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -65.29 -38.87 91.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.272 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.949 179.804 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.506 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 29.7 tpt180 . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.86 0.362 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.437 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 92.1 t -57.46 -53.3 45.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.347 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.83 -36.74 84.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -59.89 -43.8 97.71 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.341 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.535 ' HB3' HD11 ' A' ' 184' ' ' LEU . 77.5 mt -67.1 -41.6 86.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.89 0.376 . . . . 0.0 110.807 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -63.18 -49.63 73.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.591 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.441 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.36 -41.49 89.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.585 0.231 . . . . 0.0 110.922 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.1 mm-40 -58.61 -41.32 85.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 135' ' ' LEU . 1.7 tm? -59.95 -43.97 94.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.641 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.84 71.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.968 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 133' ' ' LYS . 70.9 mt -58.5 -46.54 89.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.542 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' HB3' ' A' ' 176' ' ' LYS . 96.0 mt-10 -59.62 -45.32 92.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.79 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.596 ' HB3' HE21 ' A' ' 143' ' ' GLN . 70.6 mt -62.16 -33.57 74.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.341 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -58.67 -48.46 81.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.702 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.4 t -71.4 -42.21 73.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.17 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.665 ' HZ3' ' HD3' ' A' ' 174' ' ' LYS . 39.5 ttmt -58.67 -50.15 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.596 HE21 ' HB3' ' A' ' 139' ' ' LEU . 74.7 mt-30 -62.34 -42.98 99.83 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.649 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.24 -38.01 93.87 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.104 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.21 -40.94 86.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.97 0.414 . . . . 0.0 110.375 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.9 mt-10 -59.09 -44.6 91.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.268 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -39.84 91.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.798 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.0 mtp -64.57 -37.21 86.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.693 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 72.4 mt -64.62 -45.84 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.817 0.342 . . . . 0.0 111.042 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.61 -42.28 74.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.352 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 88.8 m -68.13 -48.54 65.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.656 -179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.448 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 1.3 m-85 . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.67 -179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.731 0.3 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.448 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 91.8 mt -61.35 -39.89 92.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.556 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 152' ' ' TYR . 65.5 tp -58.66 -45.59 89.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.649 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.441 HD23 ' NE2' ' A' ' 167' ' ' GLN . 91.1 mt -59.45 -40.65 87.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.57 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -57.57 -42.95 84.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.753 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -60.43 -41.96 95.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.441 ' NE2' HD23 ' A' ' 164' ' ' LEU . 73.1 mt-30 -57.54 -43.06 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.319 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.783 ' HA ' HE21 ' A' ' 171' ' ' GLN . 41.1 tt0 -60.34 -40.57 91.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.126 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.523 ' HA ' ' OD2' ' A' ' 172' ' ' ASP . 0.0 OUTLIER -60.74 -36.61 79.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.847 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.8 tm? -69.2 -45.81 68.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.707 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.783 HE21 ' HA ' ' A' ' 168' ' ' GLN . 24.6 pt20 -64.76 -45.96 84.15 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 169' ' ' MET . 3.0 p30 -64.42 -37.73 88.55 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.07 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.407 ' HB2' ' HB2' ' A' ' 142' ' ' LYS . 90.3 p -62.76 -44.04 97.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.665 ' HD3' ' HZ3' ' A' ' 142' ' ' LYS . 74.9 mmtt -54.84 -48.15 73.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.307 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.1 m -56.06 -43.44 77.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.959 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.465 ' HB3' ' CD ' ' A' ' 138' ' ' GLU . 63.3 mttp -53.37 -46.89 69.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.052 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.521 HD13 ' HZ1' ' A' ' 142' ' ' LYS . 1.8 mp -58.16 -41.74 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.691 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . 0.415 ' HA ' ' HD2' ' A' ' 181' ' ' ARG . 1.2 m-20 -55.76 -44.37 77.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.194 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 1.7 mp -59.36 -46.34 92.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.163 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.683 ' O ' HD13 ' A' ' 184' ' ' LEU . 44.6 mt -57.81 -41.11 79.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.728 0.299 . . . . 0.0 110.889 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 98.4 mtt180 -55.04 -50.32 69.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.225 0.536 . . . . 0.0 110.82 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 25.1 ttm -67.49 -42.99 82.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.093 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 3.3 mm100 -62.16 -47.8 82.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.82 0.343 . . . . 0.0 111.474 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 180' ' ' ILE . 6.5 mp -61.69 -47.86 83.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.51 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 44.8 mmm-85 -60.25 -46.4 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.72 0.295 . . . . 0.0 110.963 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.01 -39.83 91.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.038 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.075 -179.776 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.766 0.317 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.501 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 57.3 t -61.84 -44.4 98.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.82 89.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.24 -43.13 98.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.518 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 184' ' ' LEU . 92.3 mt -67.52 -40.27 85.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.723 0.297 . . . . 0.0 111.196 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -64.44 -49.14 72.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.586 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.581 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -58.11 -41.38 83.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.876 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.03 -42.12 97.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.88 0.372 . . . . 0.0 110.76 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.503 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 67.0 tp -59.64 -45.51 91.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.102 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.68 -40.88 98.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.55 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.648 HG23 ' NZ ' ' A' ' 140' ' ' LYS . 81.8 mt -61.33 -50.14 81.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.876 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.652 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.8 pt-20 -65.86 -39.97 91.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.278 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.8 mt -58.87 -44.91 91.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 112.046 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.648 ' NZ ' HG23 ' A' ' 137' ' ' ILE . 23.5 pttm -65.68 -42.95 90.65 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.868 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.5 t -64.07 -43.51 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.967 0.413 . . . . 0.0 110.627 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.451 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttm -63.08 -43.27 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.626 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.65 -43.02 98.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.834 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.452 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.32 -38.95 96.54 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.698 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.452 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -69.01 -42.18 76.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.011 0.434 . . . . 0.0 110.95 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 55.5 mt-10 -61.72 -44.72 96.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.071 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -60.25 -44.18 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.086 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.8 mmm -64.06 -48.78 74.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.348 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.612 HD11 ' HA ' ' A' ' 167' ' ' GLN . 77.6 mt -59.69 -46.46 93.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.422 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -65.67 -41.14 92.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.443 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.6 m -58.31 -45.66 87.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.859 0.361 . . . . 0.0 110.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-30 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.718 179.662 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.232 0.182 0 CA-C-O 120.705 0.288 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.78 -32.42 72.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.951 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 45.5 tp -54.86 -50.6 68.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.843 0.354 . . . . 0.0 110.236 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 168' ' ' GLN . 81.3 mt -64.35 -37.98 89.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.874 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 96.9 m -56.58 -48.43 77.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.106 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.26 88.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.874 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.612 ' HA ' HD11 ' A' ' 149' ' ' ILE . 25.0 mt-30 -56.79 -42.76 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.446 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 164' ' ' LEU . 27.9 mt-30 -61.34 -41.59 97.29 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.228 179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.63 -47.34 84.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.494 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 57.0 tp -58.63 -40.67 83.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.887 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -57.82 -48.0 81.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.903 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.47 -42.92 97.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.412 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 49.8 m -59.04 -45.91 89.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -54.67 -42.05 70.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.493 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -58.76 -40.97 85.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.515 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.414 ' O ' HG13 ' A' ' 180' ' ' ILE . 54.5 mtpt -58.62 -46.69 86.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.221 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 2.0 mp -58.82 -42.49 85.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.311 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.4 m-20 -57.56 -54.89 41.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.737 0.303 . . . . 0.0 111.754 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.429 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.38 -46.55 96.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.602 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.652 HD12 ' OE1' ' A' ' 138' ' ' GLU . 53.9 mt -57.65 -44.46 85.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.023 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.525 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 78.1 mtp180 -56.16 -39.35 72.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.2 mmt -59.13 -41.19 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.597 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.72 -44.68 77.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -61.21 -49.64 76.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.633 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 3.5 ptm85 -59.51 -44.42 93.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.137 -179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 182' ' ' MET . 21.2 mmt85 -62.83 -38.56 91.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.961 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.593 -179.701 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 79.4 ttt180 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.863 0.363 . . . . 0.0 110.782 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 79.2 t -58.94 -51.29 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.59 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.77 -39.44 93.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.294 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.605 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -59.2 -44.69 96.24 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.58 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 87.6 mt -65.39 -44.33 87.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.853 0.358 . . . . 0.0 111.143 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.73 -46.39 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.734 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 24.2 pttm -58.98 -38.48 79.23 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.662 0.268 . . . . 0.0 110.778 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.3 mm100 -59.71 -46.49 88.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.787 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 62.2 tp -56.98 -44.85 83.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.568 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.86 -51.06 71.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.773 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.518 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.8 mt -60.97 -46.3 96.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.189 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.647 ' HB3' HG12 ' A' ' 177' ' ' ILE . 0.2 OUTLIER -57.39 -46.27 83.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.951 -179.779 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 94.2 mt -58.1 -42.66 86.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.662 0.268 . . . . 0.0 111.053 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.482 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 7.4 tmtm? -62.13 -45.88 91.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.492 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 137' ' ' ILE . 47.8 t -62.49 -44.49 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.205 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.89 -45.23 93.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.942 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -62.04 -39.54 92.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.695 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.3 -40.99 96.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.51 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.15 -42.77 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.981 0.419 . . . . 0.0 110.412 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 51.0 mt-10 -61.96 -40.4 95.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.673 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.454 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 0.8 OUTLIER -58.68 -44.83 90.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.546 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.432 ' HB2' ' HE3' ' A' ' 148' ' ' MET . 69.5 mtm -66.35 -41.09 90.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.151 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.4 mt -62.8 -49.5 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.799 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 16.2 pt20 -64.13 -40.74 96.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.663 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.2 m -65.68 -42.91 90.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.472 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.1 -179.245 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 tptm . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.801 0.334 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.9 tp -67.91 -33.48 74.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 69.1 tp -56.15 -47.46 78.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.423 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.0 -42.52 94.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.568 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -59.24 -41.57 89.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.954 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.17 97.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 85.6 mt-30 -58.79 -41.71 87.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.895 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.35 -40.27 90.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.036 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.8 mtp -61.82 -48.54 80.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.787 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.525 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -57.97 -45.79 86.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.811 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 98.7 mm-40 -60.94 -41.0 95.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.164 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.56 -44.57 86.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.115 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.541 ' HA ' ' HG2' ' A' ' 176' ' ' LYS . 52.8 m -66.65 -47.2 73.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.858 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.639 ' HD3' ' N ' ' A' ' 175' ' ' THR . 0.0 OUTLIER -60.25 -35.64 75.95 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.826 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . 0.639 ' N ' ' HD3' ' A' ' 174' ' ' LYS . 85.7 m -71.47 -45.55 62.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 173' ' ' SER . 19.3 ptpt -63.81 -38.49 91.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.803 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.647 HG12 ' HB3' ' A' ' 138' ' ' GLU . 85.3 mt -63.37 -43.99 98.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.951 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -57.15 -44.04 83.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.966 0.413 . . . . 0.0 110.212 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 175' ' ' THR . 47.6 mm -61.2 -43.79 97.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.497 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 72.2 mt -58.82 -48.9 84.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -51.03 -41.65 59.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.252 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 48.4 tpp -60.71 -38.76 86.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.221 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.418 HE21 HD22 ' A' ' 131' ' ' LEU . 22.4 mt-30 -64.02 -43.72 94.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.967 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.2 mm? -60.64 -54.57 43.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.497 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -60.08 -41.05 91.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.682 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.24 -36.28 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.214 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.389 -179.525 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.43 HH11 ' HG3' ' A' ' 127' ' ' ARG . 46.2 ttm-85 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.77 0.319 . . . . 0.0 111.446 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 1.4 p -60.75 -44.55 97.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.255 0.55 . . . . 0.0 110.9 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.455 ' N ' ' CG1' ' A' ' 128' ' ' VAL . . . -58.44 -44.21 89.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.457 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.467 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.29 -44.2 98.01 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.785 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.56 HD13 ' HG ' ' A' ' 184' ' ' LEU . 92.6 mt -66.88 -42.42 85.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.28 . . . . 0.0 111.412 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 51.0 mt-10 -64.07 -47.92 78.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.865 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.07 -42.64 90.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.645 0.26 . . . . 0.0 111.154 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.562 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.6 mm100 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.92 0.391 . . . . 0.0 110.697 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 135' ' ' LEU . 2.8 tm? -58.76 -40.31 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.426 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' ' 140' ' ' LYS . . . -66.91 -43.34 83.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.385 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 133' ' ' LYS . 64.8 mt -59.99 -49.66 83.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.06 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 11.0 pt-20 -58.12 -43.28 87.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.065 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.3 mt -60.1 -42.24 94.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.665 0.269 . . . . 0.0 111.33 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 136' ' ' ALA . 14.6 mmmm -60.11 -47.31 86.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.711 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 48.4 t -64.56 -42.14 94.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.276 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.03 -50.96 71.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.269 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -64.61 -49.18 72.1 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.246 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -55.51 -36.27 63.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.974 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.2 -40.74 94.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 110.131 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.0 mt-10 -62.07 -44.51 96.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.552 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -60.2 -40.11 88.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.742 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.3 mtp -65.3 -44.58 87.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.2 mt -61.94 -44.2 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.354 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 97.4 mm-40 -67.09 -45.48 77.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.443 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -61.92 -50.34 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.644 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.644 -179.636 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 61.2 mttp . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.797 0.332 . . . . 0.0 110.764 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.96 -38.13 87.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.1 tp -56.94 -47.71 80.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.06 -41.2 99.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.0 m -60.18 -47.04 87.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.62 75.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.216 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -57.34 -37.23 72.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.984 0.421 . . . . 0.0 109.91 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -60.46 -40.91 92.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.042 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 165' ' ' THR . 40.9 mtm -61.78 -40.68 96.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.195 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 59.8 tp -61.36 -42.17 98.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.969 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.782 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 41.2 tt0 -57.86 -49.58 76.2 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.901 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 33.3 m-20 -63.0 -40.85 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.769 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 177' ' ' ILE . 45.7 t -57.88 -44.77 86.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.782 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 53.8 mtmt -58.3 -51.62 69.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.936 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.8 m -55.63 -41.8 74.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.955 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 172' ' ' ASP . 75.7 mmtt -60.88 -43.65 98.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.764 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.516 HG12 ' CD ' ' A' ' 138' ' ' GLU . 49.3 mt -60.93 -44.92 98.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.698 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.93 -47.37 80.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 111.587 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 69.9 mt -64.99 -50.66 73.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.515 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.562 HD13 ' HB3' ' A' ' 134' ' ' GLN . 44.7 mt -59.28 -58.92 4.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.86 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -51.01 -39.03 54.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.051 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.8 ttm -61.15 -39.41 89.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.89 0.376 . . . . 0.0 110.162 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 11.9 mm100 -62.01 -43.37 98.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.876 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.56 ' HG ' HD13 ' A' ' 131' ' ' LEU . 9.5 mp -58.87 -45.97 88.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.859 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.427 ' HG2' HH11 ' A' ' 185' ' ' ARG . 47.5 mtp85 -56.0 -44.35 78.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 186' ' ' ARG . 12.1 tpt180 -60.9 -33.7 73.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.646 -179.528 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 39.8 ttm180 . . . . . 0 N--CA 1.457 -0.1 0 CA-C-O 120.79 0.329 . . . . 0.0 111.052 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 74.5 t -60.09 -50.67 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.602 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.9 95.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.55 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.84 -41.25 99.13 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.375 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.594 ' HB3' HD21 ' A' ' 184' ' ' LEU . 97.2 mt -67.79 -44.39 77.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.789 0.328 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 65.7 mm-40 -62.82 -47.61 82.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.713 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.65 -42.65 97.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.436 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -59.0 -52.05 67.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.674 0.273 . . . . 0.0 111.159 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.56 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 52.7 tp -52.15 -43.08 63.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.123 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.99 86.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.218 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.9 mt -60.05 -51.37 73.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.585 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.464 ' HG3' ' HE3' ' A' ' 176' ' ' LYS . 5.1 mp0 -60.57 -37.45 81.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.4 mt -59.67 -44.95 93.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.782 0.325 . . . . 0.0 111.06 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -67.91 -46.83 70.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.391 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.0 t -63.01 -46.66 95.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.481 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.496 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 64.0 tttm -62.68 -45.81 91.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.801 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.66 -45.88 92.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.64 -39.98 97.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.564 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.44 -42.2 92.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 110.308 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.5 mt-10 -63.58 -40.63 97.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.677 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.67 -45.04 81.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.232 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.93 -42.02 81.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 145' ' ' ALA . 88.8 mt -58.39 -44.28 88.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.302 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.2 mt-30 -64.36 -46.35 83.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.456 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 52.1 m -62.82 -50.66 70.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.062 -179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.615 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.8 m-85 . . . . . 0 C--N 1.327 -0.402 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.76 -178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 mttp . . . . . 0 C--O 1.232 0.179 0 CA-C-O 120.738 0.304 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.577 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.7 mt -60.31 -36.84 78.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.796 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' HB2' ' A' ' 152' ' ' TYR . 47.9 tp -56.09 -44.81 79.37 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.93 -43.65 98.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.454 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 91.0 m -62.09 -41.38 98.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -59.09 -42.56 90.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.008 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -59.34 -44.93 92.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.055 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -62.08 -37.54 85.43 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.959 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 169' ' ' MET . 0.0 OUTLIER -58.07 -44.45 87.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.83 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.496 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 51.1 tp -65.37 -40.57 93.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.158 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -59.29 -46.29 88.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.442 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -65.03 -46.05 82.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.551 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.524 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -59.79 -47.4 85.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.605 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -58.52 -42.54 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.598 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.2 m -58.81 -50.6 73.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.744 0.307 . . . . 0.0 111.293 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.464 ' HE3' ' HG3' ' A' ' 138' ' ' GLU . 52.5 mtmt -57.7 -40.84 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.028 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 173' ' ' SER . 73.1 mt -61.58 -38.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.321 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.65 -50.55 72.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.389 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.447 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -64.87 -50.14 76.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.332 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 66.1 mt -59.14 -43.22 88.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.868 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.1 tpt180 -54.83 -43.11 72.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.596 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.0 -44.95 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.606 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -61.97 -36.18 80.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.94 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.6 mm? -69.25 -41.98 76.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.425 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 79.3 mtp180 -58.09 -51.8 68.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 186' ' ' ARG . 3.7 ptp180 -63.35 -36.31 83.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.159 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.872 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.526 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 21.3 tpp180 . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.687 0.28 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.59 -49.45 84.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.586 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.45 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.409 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.506 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.66 -42.33 99.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.394 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.6 ' HB3' HD22 ' A' ' 184' ' ' LEU . 83.2 mt -66.5 -44.19 83.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 0.0 110.954 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -64.26 -47.1 80.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.967 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.628 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -57.53 -42.12 82.24 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.596 0.236 . . . . 0.0 110.944 -179.482 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.531 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 3.4 mm100 -59.15 -43.68 92.08 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.798 0.332 . . . . 0.0 110.518 179.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 89.9 mt -60.04 -40.93 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.005 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.54 -47.37 86.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.164 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -58.78 -38.93 75.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.811 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.637 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.9 mm-40 -59.44 -46.58 88.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.235 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.4 mt -59.76 -39.81 86.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.274 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -61.46 -47.77 84.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.138 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.4 -47.1 68.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.509 ' HE3' ' HD3' ' A' ' 174' ' ' LYS . 87.2 tttt -58.45 -49.51 77.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.191 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -59.71 -43.68 94.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.562 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.725 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -58.09 -41.38 94.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.367 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.463 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.36 -40.97 94.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.056 0.455 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 56.6 mt-10 -62.75 -40.02 95.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.469 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.725 HD22 ' HA2' ' A' ' 144' ' ' GLY . 80.2 m-20 -58.03 -45.44 86.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.756 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 44.3 mtm -64.78 -47.23 78.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.938 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.5 mt -55.21 -45.58 77.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.03 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.4 mt-30 -64.54 -40.8 96.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.781 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.1 m -60.33 -45.57 92.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.242 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.412 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.0 m-30 . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.936 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 161' ' ' LYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.675 0.274 . . . . 0.0 111.325 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.4 mp -70.57 -31.66 68.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.589 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 65.0 tp -56.59 -52.02 66.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.837 0.351 . . . . 0.0 110.417 179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.73 -39.38 93.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.014 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 169' ' ' MET . 92.7 m -58.48 -39.94 81.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.669 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.59 94.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.777 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -56.89 -44.47 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.293 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.3 tp60 -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.291 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 165' ' ' THR . 77.9 mmm -63.03 -49.96 72.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.138 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.494 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -58.03 -46.6 85.05 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.609 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -64.94 -40.87 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.179 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.2 -47.63 85.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.31 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -60.27 -44.32 95.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.154 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.583 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.93 -42.16 84.28 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.202 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.2 m -60.45 -47.26 86.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.143 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -62.21 -43.16 99.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.932 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.637 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.9 mt -60.83 -44.14 97.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -56.41 -43.39 79.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.912 0.387 . . . . 0.0 110.334 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.497 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 68.2 mt -61.73 -44.8 99.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.819 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.43 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 70.2 mt -61.08 -45.81 97.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.436 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' A' ' 184' ' ' LEU . 29.2 tpt180 -53.71 -46.98 70.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.77 0.319 . . . . 0.0 110.813 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.6 mmt -59.24 -38.94 81.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.288 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 84.7 mt-30 -64.85 -36.34 84.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.028 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 131' ' ' LEU . 9.4 mt -60.19 -50.87 71.97 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.185 0.517 . . . . 0.0 110.818 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -61.64 -45.82 92.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.14 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.8 ttt180 -66.44 -33.85 76.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.208 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.765 -179.585 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.827 0.346 . . . . 0.0 110.705 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -63.14 -40.04 87.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.974 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.39 98.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.807 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -64.34 -46.94 89.25 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.702 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.471 ' HB3' HD22 ' A' ' 184' ' ' LEU . 79.6 mt -66.86 -41.13 87.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.997 0.427 . . . . 0.0 111.06 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -62.55 -48.35 79.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.807 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.5 pttt -60.62 -40.5 92.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.546 0.212 . . . . 0.0 111.118 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.4 mm-40 -58.55 -44.56 89.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.893 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.579 HD21 HD11 ' A' ' 184' ' ' LEU . 95.6 mt -60.21 -42.2 94.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.09 -45.3 95.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.08 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.508 ' O ' HG23 ' A' ' 141' ' ' VAL . 67.5 mt -62.26 -42.85 96.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.101 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.684 ' HB3' HD11 ' A' ' 177' ' ' ILE . 59.3 mm-40 -59.29 -45.96 89.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.327 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.6 mt -58.72 -41.55 86.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.009 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -64.99 -45.74 84.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.164 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.1 t -65.2 -46.08 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.484 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -63.69 -47.15 82.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.102 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.696 HE21 HD21 ' A' ' 147' ' ' ASN . 70.7 tp60 -60.71 -45.27 94.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -65.77 -35.18 90.6 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.421 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.558 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.23 -43.64 81.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.993 0.425 . . . . 0.0 110.53 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.8 mt-10 -60.94 -41.18 95.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.784 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.696 HD21 HE21 ' A' ' 143' ' ' GLN . 3.7 m120 -59.0 -46.14 88.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.636 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.468 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 83.3 mtp -63.44 -47.07 83.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.921 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 145' ' ' ALA . 83.1 mt -53.01 -47.92 53.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.987 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.42 -35.88 80.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.121 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 98.8 m -58.18 -52.7 64.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.064 -179.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.759 ' HB2' HD13 ' A' ' 163' ' ' LEU . 21.3 m-85 . . . . . 0 C--N 1.33 -0.255 0 CA-C-O 120.706 0.288 . . . . 0.0 111.377 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp . . . . . 0 C--O 1.231 0.117 0 CA-C-O 120.601 0.238 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 152' ' ' TYR . 3.6 mm? -65.55 -40.0 92.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.601 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 152' ' ' TYR . 56.0 tp -57.22 -44.53 83.82 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.542 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.38 -41.25 96.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.248 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.432 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.1 m -59.56 -42.95 93.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.588 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.94 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.711 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.37 -45.82 90.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -38.78 88.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.454 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.432 ' HG3' ' O ' ' A' ' 165' ' ' THR . 73.3 mtp -59.94 -48.36 82.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.032 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 57.2 tp -58.42 -46.2 86.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.256 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.87 -43.96 94.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.259 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.69 -45.78 92.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.164 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.57 ' HA ' ' NZ ' ' A' ' 176' ' ' LYS . 80.8 p -61.04 -45.55 94.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.89 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 58.2 mtpt -59.89 -38.66 82.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.018 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.8 m -58.61 -48.05 82.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.963 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 173' ' ' SER . 37.3 mtmm -63.53 -40.54 97.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.876 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.684 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.2 mt -60.32 -40.16 83.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.209 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.92 -47.35 85.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.408 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 63.1 mt -62.73 -48.59 87.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.016 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 64.5 mt -60.68 -40.09 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.605 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -53.87 -45.14 70.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.352 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.52 -39.85 92.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.186 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 9.9 mm100 -62.05 -43.07 99.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.145 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.579 HD11 HD21 ' A' ' 135' ' ' LEU . 9.3 mt -58.75 -51.15 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.104 0.478 . . . . 0.0 110.624 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 44.5 mmm-85 -57.2 -41.83 80.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.789 179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 52.7 ttp85 -64.12 -37.01 85.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.414 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.492 -179.602 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.466 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 18.3 ttp-105 . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 120.768 0.318 . . . . 0.0 111.082 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 73.7 t -59.14 -50.51 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.418 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.07 85.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.269 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.84 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.14 -44.19 98.46 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.342 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.673 HD13 ' HG ' ' A' ' 184' ' ' LEU . 74.1 mt -66.83 -42.73 85.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.895 0.379 . . . . 0.0 110.882 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.5 mt-10 -62.86 -48.42 79.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.923 -179.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.84 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.7 pttp -59.48 -40.59 87.47 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.013 -179.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.589 HE21 ' NZ ' ' A' ' 133' ' ' LYS . 88.0 mm-40 -58.2 -44.71 88.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 110.797 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.6 mt -60.39 -44.66 95.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.29 95.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.319 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 133' ' ' LYS . 74.7 mt -59.79 -42.27 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.638 ' HB3' HD11 ' A' ' 177' ' ' ILE . 66.4 mm-40 -62.41 -41.73 98.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.369 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 98.3 mt -60.42 -40.21 90.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.372 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.55 -48.76 76.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.363 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 49.0 t -67.82 -47.29 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.489 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.4 tttm -59.36 -46.6 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.087 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.04 -46.28 89.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.645 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.618 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -60.6 -35.29 89.02 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.966 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.72 -40.5 92.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.872 0.367 . . . . 0.0 110.125 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 94.9 mt-10 -60.23 -42.44 95.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.546 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.618 HD22 ' HA2' ' A' ' 144' ' ' GLY . 77.2 m-20 -59.69 -45.89 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.835 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 88.5 mmm -67.72 -44.29 77.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.249 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.609 HD12 HD12 ' A' ' 170' ' ' LEU . 91.2 mt -61.8 -46.62 96.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.674 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -64.76 -42.91 94.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.816 0.341 . . . . 0.0 111.204 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.5 m -63.34 -48.6 77.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.494 -179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.527 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 2.1 m-30 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.994 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.935 0.398 . . . . 0.0 110.477 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.527 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 94.1 mt -63.26 -35.5 80.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.544 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.562 HD13 ' C ' ' A' ' 163' ' ' LEU . 3.1 tm? -54.49 -58.04 9.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.934 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.0 mt -54.73 -37.09 65.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.4 m -57.54 -50.17 73.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.21 97.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.439 ' OE1' HD13 ' A' ' 149' ' ' ILE . 14.1 mm-40 -57.12 -44.72 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.394 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -37.57 87.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 74.5 mtp -61.15 -50.77 71.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.445 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.609 HD12 HD12 ' A' ' 149' ' ' ILE . 3.5 tt -64.7 -46.74 81.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.682 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.479 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 8.3 tt0 -56.49 -44.55 80.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 176' ' ' LYS . 34.5 t70 -62.15 -42.12 98.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 177' ' ' ILE . 59.9 m -59.69 -48.19 82.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.374 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.479 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 55.2 mtmt -57.22 -49.27 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 111.38 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.4 m -55.59 -46.9 77.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.296 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.505 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 53.6 mtmt -59.6 -40.94 89.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 138' ' ' GLU . 65.4 mt -63.9 -38.45 82.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.015 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -57.57 -48.33 79.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.353 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.56 -40.25 83.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.36 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.47 ' O ' HD13 ' A' ' 184' ' ' LEU . 56.5 mt -57.45 -55.59 20.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.094 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -51.21 -40.04 57.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.007 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.413 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 80.6 mtp -60.03 -39.42 85.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.304 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -68.03 -43.15 79.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.673 ' HG ' HD13 ' A' ' 131' ' ' LEU . 10.0 mp -62.78 -49.58 74.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.365 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.697 ' HD3' ' N ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -60.73 -36.45 78.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.724 0.297 . . . . 0.0 110.451 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.697 ' N ' ' HD3' ' A' ' 185' ' ' ARG . 22.4 tpp180 -65.28 -42.37 93.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.153 179.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.787 179.656 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.817 0.341 . . . . 0.0 110.949 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.491 HG12 ' OE2' ' A' ' 132' ' ' GLU . 50.8 t -59.68 -44.02 92.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.11 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -62.55 -41.18 98.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.099 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.49 -39.77 97.78 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.821 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.679 ' O ' ' HG2' ' A' ' 134' ' ' GLN . 84.8 mt -70.71 -38.74 73.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.722 0.296 . . . . 0.0 111.192 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.491 ' OE2' HG12 ' A' ' 128' ' ' VAL . 49.6 mt-10 -67.28 -48.31 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.495 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -63.45 -41.71 98.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.187 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.894 ' HG3' HD13 ' A' ' 180' ' ' ILE . 1.5 pt20 -60.41 -43.11 97.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.897 0.38 . . . . 0.0 110.206 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -54.25 -42.16 69.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -64.76 -37.04 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.765 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 134' ' ' GLN . 69.0 mt -53.37 -49.46 53.31 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.72 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.572 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -61.69 -45.96 91.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.535 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.47 -38.21 71.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.379 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 98.3 mttt -63.45 -51.37 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.254 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.9 t -64.92 -44.18 96.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.246 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.457 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttp -59.23 -46.14 89.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -61.72 -42.3 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.869 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.58 -41.13 97.14 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.585 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.63 -44.59 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 110.293 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 50.3 mt-10 -60.19 -40.27 89.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -57.93 -47.95 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.94 -42.32 81.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.262 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 145' ' ' ALA . 96.2 mt -53.93 -46.88 64.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 95.4 mm-40 -65.2 -39.77 93.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.184 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.6 m -64.68 -46.25 83.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.902 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.724 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.985 -179.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . 0.478 ' HD3' ' C ' ' A' ' 161' ' ' LYS . 7.3 tmtm? . . . . . 0 C--O 1.235 0.297 0 CA-C-O 121.015 0.436 . . . . 0.0 109.964 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.724 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 92.9 mt -64.27 -32.68 74.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.216 179.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 47.8 tp -56.33 -51.9 66.55 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.31 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.58 -42.85 79.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.4 m -56.55 -41.79 77.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.202 0.525 . . . . 0.0 109.661 178.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.51 76.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.507 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 14.2 mm100 -56.45 -44.35 80.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.138 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.0 tp60 -65.69 -40.19 92.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.124 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.8 mtp -56.73 -47.58 79.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.989 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 54.5 tp -60.32 -45.49 93.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.323 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.68 -47.05 87.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.037 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.19 -40.8 97.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.812 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 177' ' ' ILE . 48.8 m -59.97 -45.87 91.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.909 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.5 mtpp -58.84 -41.25 86.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.977 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.6 m -58.77 -44.32 90.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.739 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -62.58 -41.53 99.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.572 HG12 ' HB3' ' A' ' 138' ' ' GLU . 62.1 mt -58.56 -42.9 85.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . 0.495 ' HA ' ' HE ' ' A' ' 181' ' ' ARG . 27.2 m-20 -61.44 -41.01 96.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.33 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.86 -44.12 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.127 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.894 HD13 ' HG3' ' A' ' 134' ' ' GLN . 53.5 mt -58.74 -48.79 84.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.806 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.495 ' HE ' ' HA ' ' A' ' 178' ' ' ASP . 84.8 mtm180 -53.96 -40.8 67.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.563 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 25.8 mmt -60.05 -46.54 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.565 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.4 -41.98 90.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.911 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.659 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.3 mm? -61.05 -42.31 98.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.201 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 71.3 mtt-85 -58.01 -51.27 70.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 182' ' ' MET . 10.5 mpt_? -66.04 -36.81 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.812 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.791 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 . . . . . 0 C--O 1.231 0.114 0 N-CA-C 111.565 0.209 . . . . 0.0 111.565 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.27 -48.28 89.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.677 -179.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.97 95.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.569 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.592 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -65.07 -48.53 69.75 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.909 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.664 ' HB3' HD21 ' A' ' 184' ' ' LEU . 90.3 mt -64.94 -41.59 95.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.924 0.393 . . . . 0.0 111.31 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -61.09 -51.09 70.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.864 -179.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 14.8 ptmm? -59.48 -39.21 83.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.239 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.5 mm-40 -58.21 -44.44 88.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.713 0.292 . . . . 0.0 110.999 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.8 mt -58.77 -44.13 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.306 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.75 84.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.436 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.09 -42.49 86.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.354 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.729 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.7 mm-40 -60.06 -43.44 95.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.32 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 88.5 mt -58.42 -43.07 88.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.051 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -59.77 -48.45 81.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.508 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.8 t -68.61 -46.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.524 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 37.4 ttmt -59.25 -49.23 78.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.399 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -63.36 -42.34 98.88 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.809 0.338 . . . . 0.0 110.784 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.79 -39.16 94.99 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.947 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -64.63 -40.05 94.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.106 0.479 . . . . 0.0 109.92 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 142' ' ' LYS . 64.8 mm-40 -59.81 -39.42 84.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.341 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.61 -44.05 96.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.231 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 80.5 mtp -67.09 -41.31 86.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.228 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.0 mt -61.14 -49.26 85.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.667 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -68.98 -44.14 73.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.6 m -64.66 -47.09 79.75 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.752 0.311 . . . . 0.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.457 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 1.4 m-30 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.578 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 87.9 tttt . . . . . 0 C--O 1.233 0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 162' ' ' LEU . 3.7 mm? -67.24 -33.85 76.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.001 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -56.57 -44.62 81.15 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.418 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.98 -44.82 91.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.606 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 88.1 m -58.98 -43.12 91.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.916 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -60.47 -41.23 93.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -59.14 -42.76 91.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.164 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -59.22 -41.22 88.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.436 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.43 ' HB2' ' O ' ' A' ' 166' ' ' ALA . 71.6 mmm -56.42 -45.98 80.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.624 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.508 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 56.9 tp -58.28 -44.64 88.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.047 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -58.45 -43.75 88.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.382 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.48 -47.2 87.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.255 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 80.5 p -64.48 -45.41 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.541 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 29.4 mtpp -57.17 -44.16 83.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.48 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.9 m -59.16 -50.16 75.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 111.047 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -59.21 -42.25 90.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.869 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.729 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -62.07 -34.6 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.028 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -61.2 -50.75 71.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.662 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.79 -47.23 93.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.485 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.4 mt -58.51 -44.15 88.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.763 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.419 ' HG3' HH11 ' A' ' 181' ' ' ARG . 29.9 tpt85 -53.81 -42.81 68.78 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.345 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.78 -38.9 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.5 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -64.15 -45.22 89.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.042 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.4 mm? -61.67 -53.17 59.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.623 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.69 -39.55 77.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.63 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -63.28 -39.94 96.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.703 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.218 -179.886 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.465 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 47.6 ttm-85 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.76 0.314 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.63 -52.05 55.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.894 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.19 -39.27 75.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.374 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.587 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.84 -44.6 97.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.481 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 184' ' ' LEU . 87.9 mt -66.51 -47.59 72.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.015 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -57.31 -49.15 77.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.676 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.591 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -59.96 -36.03 76.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.608 0.242 . . . . 0.0 110.833 -179.731 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.805 ' HB3' HD13 ' A' ' 180' ' ' ILE . 90.5 mm-40 -57.57 -49.29 76.86 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.677 0.275 . . . . 0.0 110.862 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.3 mm? -58.98 -38.44 79.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.981 0.419 . . . . 0.0 110.968 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.44 83.97 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.743 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.462 ' O ' HG23 ' A' ' 141' ' ' VAL . 65.5 mt -65.3 -50.7 71.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.759 -179.414 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.522 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -55.0 -46.53 75.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.808 -179.441 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.8 mt -62.3 -41.07 98.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.721 0.296 . . . . 0.0 110.866 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -62.21 -44.62 96.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.692 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.8 t -64.91 -43.69 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.974 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.503 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.62 -45.68 93.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.624 179.804 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -62.69 -45.9 90.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.464 179.616 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.661 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -60.3 -37.7 93.46 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.124 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.53 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -64.26 -39.38 93.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.077 0.465 . . . . 0.0 110.014 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -62.84 -46.29 88.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.283 179.324 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . 0.661 HD22 ' HA2' ' A' ' 144' ' ' GLY . 75.5 m-20 -55.89 -40.52 73.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.109 179.346 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.541 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.6 mmm -61.87 -47.31 85.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.747 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 68.9 mt -56.31 -50.84 69.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.929 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.85 -38.72 82.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.495 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.3 m -58.25 -45.93 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.408 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.8 m-85 . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.31 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 60.8 pttt . . . . . 0 C--O 1.234 0.242 0 CA-C-O 120.749 0.309 . . . . 0.0 111.691 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.408 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.2 mt -59.12 -40.75 86.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.37 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 51.7 tp -60.57 -42.78 97.33 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.408 179.877 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.431 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 97.3 mt -55.33 -41.26 72.19 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.022 0.439 . . . . 0.0 109.95 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.417 ' O ' ' HG2' ' A' ' 169' ' ' MET . 89.4 m -60.38 -45.02 95.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.89 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.76 -45.47 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.395 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -56.13 -44.36 79.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 98.2 mm-40 -62.37 -38.04 88.03 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.452 179.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 165' ' ' THR . 72.5 mmm -62.39 -46.09 90.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.132 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.53 HD23 ' HB3' ' A' ' 145' ' ' ALA . 3.2 tm? -58.97 -46.76 87.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.784 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.54 -43.13 85.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.172 -179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -60.98 -45.07 96.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.082 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.531 ' O ' HG13 ' A' ' 177' ' ' ILE . 85.1 p -58.46 -45.31 88.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.871 -179.767 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -57.17 -42.67 81.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.754 179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 79.7 m -59.57 -44.36 93.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.585 179.623 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.2 mtpp -61.08 -41.92 97.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.48 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 173' ' ' SER . 64.4 mt -58.53 -41.02 80.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.836 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.41 -46.09 91.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.369 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.11 -46.16 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.437 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.805 HD13 ' HB3' ' A' ' 134' ' ' GLN . 69.8 mt -59.17 -40.61 81.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.29 179.28 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -55.24 -42.55 73.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.375 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -61.75 -40.47 95.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.459 179.408 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -64.44 -41.65 96.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 131' ' ' LEU . 4.5 mm? -64.38 -50.95 65.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.595 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 15.7 ptp180 -57.86 -44.74 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.654 0.264 . . . . 0.0 111.166 -179.344 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -64.44 -41.46 96.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.343 . . . . 0.0 110.953 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.001 179.895 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 19.7 ttm105 . . . . . 0 CA--C 1.528 0.114 0 CA-C-O 120.824 0.345 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.04 -49.82 73.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.978 -179.429 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.01 95.86 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 -179.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.09 -51.44 56.86 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.796 -179.619 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 184' ' ' LEU . 88.7 mt -65.77 -38.2 88.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.845 0.355 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -62.06 -49.07 77.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.916 -179.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.498 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -61.72 -40.76 96.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.045 -179.377 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.792 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.5 mm100 -58.56 -44.93 89.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.747 0.308 . . . . 0.0 110.836 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' HE ' ' A' ' 181' ' ' ARG . 98.6 mt -62.53 -36.4 82.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.136 0.494 . . . . 0.0 111.041 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -67.4 -48.57 66.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.433 -179.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.46 -47.33 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.936 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.538 ' CG ' HG12 ' A' ' 177' ' ' ILE . 12.2 pt-20 -58.28 -39.61 79.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.15 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.497 ' C ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -70.18 -39.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.53 -179.925 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 68.4 mttm -59.34 -48.04 83.14 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.818 0.342 . . . . 0.0 110.735 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.46 -40.89 87.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.1 tttm -59.67 -44.49 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.737 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -65.24 -42.38 93.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.56 -40.94 95.22 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.476 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.462 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.64 -40.65 92.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.307 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.27 -39.78 94.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 179.507 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.06 -44.13 91.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.492 179.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.88 -45.67 88.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.088 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 145' ' ' ALA . 68.4 mt -57.88 -47.06 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.33 -47.58 73.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.765 -179.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 92.6 m -61.26 -47.84 84.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.898 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.611 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.5 m-85 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.997 -179.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 27.4 tptp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.668 0.271 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . 0.611 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 93.0 mt -64.38 -34.92 79.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.91 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 56.8 tp -55.28 -48.93 73.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.759 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.41 -42.33 98.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.397 179.681 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.8 m -59.02 -42.03 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.972 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.4 94.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.5 -44.64 85.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.273 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -61.33 -40.38 94.0 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.475 179.241 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.9 mtp -58.77 -47.66 83.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.441 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.897 HD22 ' HE3' ' A' ' 174' ' ' LYS . 2.0 tt -60.87 -40.69 93.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.963 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -59.49 -41.46 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 179.479 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -61.68 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.839 179.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 177' ' ' ILE . 94.1 p -59.1 -40.21 84.64 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.384 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.897 ' HE3' HD22 ' A' ' 170' ' ' LEU . 99.6 mttt -57.29 -44.19 83.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.388 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.2 m -59.82 -48.13 82.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.36 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.565 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 3.4 mmmp? -62.28 -47.32 84.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.992 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.538 HG12 ' CG ' ' A' ' 138' ' ' GLU . 60.6 mt -57.62 -46.31 86.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.71 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -58.84 -47.3 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.663 0.268 . . . . 0.0 111.532 -179.56 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.65 -50.58 75.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.9 -179.417 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.792 HD13 ' HB3' ' A' ' 134' ' ' GLN . 66.0 mt -61.3 -44.41 98.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.558 ' HE ' HD22 ' A' ' 135' ' ' LEU . 19.4 mmt85 -56.22 -40.83 74.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.805 0.336 . . . . 0.0 110.509 179.602 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.0 tpp -59.96 -43.4 95.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.272 179.291 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.94 -40.29 97.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.679 179.517 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -62.25 -44.24 96.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 78.0 mtp180 -57.6 -43.9 85.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.619 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 186' ' ' ARG . 43.0 mmm-85 -62.33 -42.26 99.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.036 -179.997 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.409 ' HG2' HH11 ' A' ' 127' ' ' ARG . 15.2 tpp85 . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.687 0.28 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.8 -41.29 75.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.772 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.24 74.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.332 179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.847 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.86 -57.79 15.88 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.132 179.652 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.857 HD23 HD12 ' A' ' 184' ' ' LEU . 6.8 mp -53.63 -46.12 70.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -58.05 -55.0 40.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.681 0.277 . . . . 0.0 111.478 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.847 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.3 pttp -60.79 -34.16 74.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.895 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.797 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.3 mm100 -60.64 -50.21 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.247 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.6 mm? -55.61 -43.5 76.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.843 0.354 . . . . 0.0 111.094 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.99 79.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 133' ' ' LYS . 68.5 mt -63.16 -42.53 96.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.581 -179.682 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.716 ' HB3' HD11 ' A' ' 177' ' ' ILE . 69.0 mm-40 -59.09 -44.88 91.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.43 -179.601 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.3 mt -60.32 -40.71 91.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.773 0.32 . . . . 0.0 111.001 -179.873 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -62.11 -50.13 73.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.493 -179.795 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.75 -49.96 64.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.993 -179.34 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.9 tttt -57.57 -44.86 85.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.338 -179.433 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.87 -51.21 70.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.496 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.39 -34.83 86.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.542 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.23 -40.95 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.983 0.42 . . . . 0.0 110.421 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -60.71 -43.72 97.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.743 179.706 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.23 -43.37 98.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.933 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 84.1 mtp -63.33 -47.26 82.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.965 179.899 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.1 mt -56.68 -47.95 81.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -65.12 -40.03 93.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.039 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.4 m -56.87 -46.03 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.627 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.494 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.9 m-85 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.341 -179.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.9 pttp . . . . . 0 CA--C 1.528 0.134 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 77.3 mt -61.17 -45.85 92.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.226 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 152' ' ' TYR . 57.3 tp -60.33 -45.65 92.68 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.0 -0.28 . . . . 0.0 111.119 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 168' ' ' GLN . 94.8 mt -57.27 -37.26 72.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.774 0.321 . . . . 0.0 110.712 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . 0.48 ' O ' ' HG3' ' A' ' 169' ' ' MET . 88.4 m -61.81 -47.52 84.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.163 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . 0.405 ' HB2' ' HE2' ' A' ' 148' ' ' MET . . . -68.15 -49.18 62.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.446 -179.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.413 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 25.9 mt-30 -56.96 -36.4 70.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 109.989 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . 0.558 ' HB2' ' O ' ' A' ' 164' ' ' LEU . 0.5 OUTLIER -62.21 -45.91 91.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.997 179.63 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . 0.48 ' HG3' ' O ' ' A' ' 165' ' ' THR . 58.8 mtm -60.48 -39.33 87.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.9 tm? -60.77 -42.04 96.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.437 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 12.0 mm100 -64.96 -47.52 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.524 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -64.08 -42.27 97.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.816 -179.356 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.526 ' O ' HG13 ' A' ' 177' ' ' ILE . 86.2 p -57.83 -47.53 82.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.33 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -60.92 -48.01 83.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.607 -179.627 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.7 m -58.04 -48.6 79.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.707 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.486 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 54.6 mtmt -59.28 -43.64 92.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.047 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.716 HD11 ' HB3' ' A' ' 138' ' ' GLU . 72.2 mt -60.9 -35.57 65.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.183 179.919 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . 0.551 ' O ' ' HG2' ' A' ' 182' ' ' MET . 65.2 m-20 -62.25 -49.82 74.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.686 0.279 . . . . 0.0 110.806 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 39.9 mm -62.42 -50.17 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.038 0.447 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.797 HD13 ' HB3' ' A' ' 134' ' ' GLN . 88.4 mt -55.37 -49.92 69.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.277 179.555 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.718 ' HA ' HD13 ' A' ' 184' ' ' LEU . 79.5 ttt180 -49.47 -40.27 36.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.348 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.4 mmt -57.8 -41.06 81.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.867 178.951 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . 0.548 ' CB ' HD21 ' A' ' 131' ' ' LEU . 25.9 mt-30 -66.62 -36.91 83.73 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.057 179.482 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.857 HD12 HD23 ' A' ' 131' ' ' LEU . 6.8 mp -61.29 -56.95 14.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.728 0.299 . . . . 0.0 111.28 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 15.0 ptp180 -60.47 -43.23 97.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.747 -179.189 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 186' ' ' ARG . 15.0 tpp85 -60.12 -44.97 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.803 0.335 . . . . 0.0 110.987 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.479 -179.822 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 20.7 ttm105 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.726 0.298 . . . . 0.0 110.761 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.471 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 60.7 t -58.55 -45.94 90.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.995 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 179.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' GLY . . . . . 0.718 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -62.09 -40.61 99.17 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.333 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 89.0 mt -67.34 -42.75 83.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.898 0.38 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 67.7 mm-40 -63.79 -46.8 83.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.75 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.718 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -59.98 -41.19 91.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.661 0.267 . . . . 0.0 111.229 -179.316 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 134' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.0 mm-40 -59.32 -46.24 89.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 135' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 60.0 tp -61.42 -41.93 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.844 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.88 85.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.285 -179.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -59.15 -42.41 86.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.708 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . 0.662 ' HB3' HD11 ' A' ' 177' ' ' ILE . 65.0 mm-40 -61.97 -40.05 94.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.129 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.6 mt -59.8 -42.4 93.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.209 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.83 -49.19 71.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.189 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.68 -46.93 93.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.166 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 142' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.8 tttm -61.88 -44.16 97.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.629 179.961 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -58.69 -44.84 90.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.06 179.675 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 144' ' ' GLY . . . . . 0.465 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -65.16 -35.08 91.27 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 145' ' ' ALA . . . . . 0.536 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.58 -41.09 89.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.542 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.0 mt-10 -61.72 -42.54 99.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.687 179.722 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -61.99 -39.44 92.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.523 179.591 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 148' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.8 mtp -67.81 -41.49 83.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.274 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 149' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 145' ' ' ALA . 73.5 mt -63.33 -47.5 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.439 -179.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 150' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 3.1 pt20 -68.83 -45.36 71.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.768 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -66.04 -48.35 71.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.873 -179.377 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 152' ' ' TYR . . . . . 0.492 ' O ' HD13 ' A' ' 163' ' ' LEU . 1.4 m-85 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.832 -179.518 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt . . . . . 0 N--CA 1.461 0.078 0 CA-C-O 120.67 0.272 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.75 -40.33 96.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.059 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 163' ' ' LEU . . . . . 0.492 HD13 ' O ' ' A' ' 152' ' ' TYR . 62.3 tp -57.43 -48.02 80.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.832 0.348 . . . . 0.0 110.578 179.739 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.9 -39.63 94.62 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.166 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.8 m -56.47 -44.61 80.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.658 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.44 -41.3 98.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 167' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.2 mt-30 -58.03 -42.53 85.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.153 179.61 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.36 -40.03 85.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.768 179.119 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.1 mtp -59.92 -47.31 86.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.634 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 170' ' ' LEU . . . . . 0.489 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.1 tm? -57.4 -47.49 81.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.675 -179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -60.59 -42.04 95.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -57.46 -46.41 83.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 173' ' ' SER . . . . . 0.512 ' O ' HG13 ' A' ' 177' ' ' ILE . 51.1 m -62.09 -42.97 99.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 -179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 174' ' ' LYS . . . . . 0.577 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.54 -42.99 84.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.492 -179.723 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.7 m -61.37 -48.73 79.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.406 -179.634 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 176' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 180' ' ' ILE . 68.3 mttm -62.87 -46.59 87.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.196 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 177' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' A' ' 138' ' ' GLU . 54.6 mt -59.99 -40.23 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.138 -179.776 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 178' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 182' ' ' MET . 8.2 t70 -58.03 -44.67 87.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.001 0.429 . . . . 0.0 109.99 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.99 -43.05 97.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.926 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 71.3 mt -59.88 -46.78 93.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.129 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 73.1 mtt-85 -55.48 -44.2 76.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 182' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 92.2 mmm -59.69 -37.5 78.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.491 179.577 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -67.34 -38.93 85.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.089 179.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 184' ' ' LEU . . . . . 0.48 HD22 HD13 ' A' ' 131' ' ' LEU . 9.2 mt -60.49 -53.95 51.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.179 0.514 . . . . 0.0 110.768 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 185' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 -64.2 -43.02 96.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.179 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 186' ' ' ARG . . . . . 0.414 HH11 ' HG3' ' A' ' 186' ' ' ARG . 46.1 ttm-85 -62.3 -36.11 81.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.129 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.414 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.682 -179.59 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.266 0 N-CA-C 112.496 -0.241 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.431 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 36.3 pt -63.91 138.38 97.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 120.563 0.221 . . . . 0.0 111.307 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 13.1 Cg_exo -69.8 70.04 1.63 Allowed 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.915 2.41 . . . . 0.0 112.222 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.472 ' O ' ' HG ' ' A' ' 125' ' ' LEU . . . -154.97 -134.68 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.266 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 67.1 p -58.86 -37.02 75.58 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -179.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -53.94 -55.18 29.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.66 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 122' ' ' ALA . 96.7 mt 53.05 30.79 10.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.173 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 56.8 m -75.82 -56.42 4.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.9 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 56.7 ttp85 -68.96 -40.93 78.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.934 179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 84.3 t -61.2 -45.7 98.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.58 -179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.98 -43.88 97.9 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.47 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.71 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -60.85 -50.67 65.01 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.809 -0.71 . . . . 0.0 113.01 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.469 HD13 HD22 ' A' ' 184' ' ' LEU . 93.4 mt -67.26 -40.2 86.2 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.82 0.343 . . . . 0.0 111.427 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -62.67 -47.15 84.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.575 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.71 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.8 pttt -60.85 -41.64 96.24 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.598 0.237 . . . . 0.0 111.116 -179.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.6 HE21 ' HE3' ' A' ' 133' ' ' LYS . 98.7 mm-40 -57.42 -44.66 84.81 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.901 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -61.31 -41.83 97.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.403 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.46 -45.71 90.83 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.23 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 70.4 mt -59.2 -41.32 83.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.908 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.526 ' HB3' ' CD1' ' A' ' 177' ' ' ILE . 62.1 mm-40 -57.95 -44.28 86.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.015 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.5 mt -61.3 -39.5 90.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.225 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -62.2 -47.84 82.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 33.5 t -72.53 -48.31 47.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.465 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.0 tttp -60.29 -54.98 39.28 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.158 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 70.5 tp60 -61.79 -38.8 89.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 110.34 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.57 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.95 -40.83 98.97 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.34 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.503 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.98 -42.11 81.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 110.568 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 49.7 mt-10 -62.5 -42.32 99.42 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.778 179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.507 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 45.2 t30 -60.61 -40.18 90.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.776 179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.57 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.3 mmm -67.93 -45.25 74.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.021 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.503 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.6 mt -57.09 -49.72 78.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.659 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.507 ' NE2' ' HA ' ' A' ' 147' ' ' ASN . 15.1 pt20 -63.59 -41.33 98.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.411 -179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 95.1 m -60.14 -44.5 94.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.552 ' CE2' ' HB3' ' A' ' 162' ' ' LEU . 7.3 m-30 -58.43 -42.85 88.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.902 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 59.2 m -60.85 -32.76 72.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.281 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -53.63 -59.95 3.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.596 -179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . 0.642 ' HA2' ' HE3' ' A' ' 158' ' ' LYS . . . 157.79 -35.07 0.54 Allowed Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.284 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.7 t -49.54 -81.3 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -179.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.663 HG22 ' H ' ' A' ' 159' ' ' ASP . 87.3 m -68.07 -67.78 0.44 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.833 0.349 . . . . 0.0 111.021 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.642 ' HE3' ' HA2' ' A' ' 155' ' ' GLY . 39.6 ttmt 51.72 28.99 5.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.673 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.663 ' H ' HG22 ' A' ' 157' ' ' THR . 59.3 m-20 -75.22 128.63 35.9 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.611 0.244 . . . . 0.0 110.579 179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 20.9 tpp180 -70.63 -48.26 55.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.321 -179.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 39.4 ttpt -58.22 -46.6 85.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.976 0.417 . . . . 0.0 110.571 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.552 ' HB3' ' CE2' ' A' ' 152' ' ' TYR . 4.5 mm? -67.02 -34.82 78.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.108 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.0 tp -56.13 -54.18 48.17 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.381 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.636 HD12 ' N ' ' A' ' 165' ' ' THR . 4.3 pp -64.29 -38.49 91.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.782 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.636 ' N ' HD12 ' A' ' 164' ' ' LEU . 84.9 m -55.63 -46.02 77.46 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.961 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.61 94.19 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.824 179.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 73.7 mt-30 -56.35 -46.42 79.98 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.572 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 5.1 tm0? -62.55 -41.15 98.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.044 179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 73.5 mtp -57.44 -47.94 80.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.098 179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.519 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.44 -44.17 97.58 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.624 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.895 ' HA ' ' HE3' ' A' ' 174' ' ' LYS . 85.7 mt-30 -59.07 -49.49 77.67 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -179.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -66.98 -41.09 87.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.784 0.326 . . . . 0.0 111.321 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.62 ' O ' HG13 ' A' ' 177' ' ' ILE . 58.2 m -62.42 -50.84 69.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 112.026 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.895 ' HE3' ' HA ' ' A' ' 171' ' ' GLN . 22.0 pttp -60.29 -40.09 89.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . 0.509 ' O ' HG13 ' A' ' 179' ' ' ILE . 85.0 m -58.18 -47.55 83.07 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.045 0.45 . . . . 0.0 111.057 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -62.04 -34.9 77.1 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.62 HG13 ' O ' ' A' ' 173' ' ' SER . 21.7 mt -60.66 -49.75 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.713 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -59.94 -36.43 77.03 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.801 0.334 . . . . 0.0 110.227 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.509 HG13 ' O ' ' A' ' 175' ' ' THR . 61.4 mt -61.96 -48.37 88.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.475 HD13 ' HB3' ' A' ' 134' ' ' GLN . 68.0 mt -61.93 -41.08 89.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -55.31 -43.86 75.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.444 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.7 ttm -60.91 -41.04 95.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.185 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -59.23 -40.67 86.61 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.693 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.469 HD22 HD13 ' A' ' 131' ' ' LEU . 11.9 mt -58.23 -54.67 44.32 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.712 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.492 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 47.9 mtp85 -54.75 -41.98 71.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.39 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.409 HH11 ' HG2' ' A' ' 186' ' ' ARG . 53.7 ttt-85 -62.8 -34.65 77.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.712 179.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.74 -45.74 91.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.128 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.47 -40.01 89.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.362 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.492 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.1 mt-30 -60.29 -45.71 92.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.371 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.4 -47.0 77.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.629 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.74 -44.21 96.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.424 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.487 ' O ' ' HB3' ' A' ' 193' ' ' LEU . 53.4 tt0 -60.3 -53.86 52.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.307 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.487 ' HB3' ' O ' ' A' ' 192' ' ' GLN . 61.6 tp 73.33 -52.06 0.7 Allowed 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.459 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 59.43 106.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.826 0.346 . . . . 0.0 111.122 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.415 ' HB3' ' H ' ' A' ' 196' ' ' GLN . 3.5 m120 50.44 -152.23 0.18 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.787 179.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.415 ' H ' ' HB3' ' A' ' 195' ' ' ASN . 64.2 tp60 -74.53 136.64 42.16 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.797 179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -59.2 135.1 57.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.927 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -59.57 133.8 88.86 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.16 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo . . . . . 0 C--O 1.248 1.004 0 C-N-CA 122.529 2.153 . . . . 0.0 112.209 179.895 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.124 0 N-CA-C 112.555 -0.218 . . . . 0.0 112.555 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.56 HG22 ' H ' ' A' ' 123' ' ' THR . 49.5 mm -62.11 129.39 92.01 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.588 0.232 . . . . 0.0 111.026 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -63.89 -46.5 8.47 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.369 2.046 . . . . 0.0 111.9 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.519 ' HB1' ' HG ' ' A' ' 125' ' ' LEU . . . -64.18 -35.27 80.23 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.891 179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.56 ' H ' HG22 ' A' ' 120' ' ' ILE . 14.9 m 66.82 46.36 1.69 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.926 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 125' ' ' LEU . 3.1 m120 73.06 -42.35 0.53 Allowed 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.139 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.519 ' HG ' ' HB1' ' A' ' 122' ' ' ALA . 94.2 mt 74.57 -42.13 0.49 Allowed 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 122.521 0.329 . . . . 0.0 111.514 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 85.1 p -65.16 -49.74 68.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.666 0.27 . . . . 0.0 111.239 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.445 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 99.8 mtt180 -62.91 -42.16 99.7 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.228 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.3 t -56.98 -51.87 63.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.375 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -62.25 -40.79 97.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.114 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.833 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.39 -43.97 98.65 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.522 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 184' ' ' LEU . 93.3 mt -67.5 -41.18 84.89 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.779 0.323 . . . . 0.0 111.197 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.2 mm-40 -63.73 -48.58 76.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.77 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.833 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.9 pttt -59.53 -41.53 90.23 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.014 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.509 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.67 -39.33 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.958 0.409 . . . . 0.0 110.686 179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.589 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 2.6 tm? -58.95 -41.74 88.18 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.392 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.92 89.25 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.157 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.477 ' O ' HG23 ' A' ' 141' ' ' VAL . 68.7 mt -65.39 -48.04 84.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 112.194 -179.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 12.2 pt-20 -59.1 -45.4 90.97 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.375 -179.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 80.9 mt -65.98 -39.04 90.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.626 0.251 . . . . 0.0 111.173 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 62.1 tttm -60.45 -44.29 95.99 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.209 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.0 t -66.26 -46.97 85.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.577 -179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.529 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 40.3 ttmt -61.63 -46.81 88.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.276 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -62.69 -48.91 77.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.641 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.52 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -60.55 -34.62 86.63 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.753 179.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.599 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.87 -44.64 76.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.873 0.368 . . . . 0.0 110.348 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 51.7 mt-10 -60.15 -41.78 93.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.87 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.428 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 20.1 t-20 -59.04 -43.77 91.7 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.341 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.523 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.8 mmm -67.5 -45.37 76.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.6 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.599 HG13 ' O ' ' A' ' 145' ' ' ALA . 89.6 mt -52.88 -53.77 19.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.407 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.428 ' HG2' ' O ' ' A' ' 147' ' ' ASN . 3.0 pt20 -58.99 -36.55 75.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.033 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 54.9 m -54.93 -54.96 36.02 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.462 -0.336 . . . . 0.0 111.862 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.605 ' HB2' HD13 ' A' ' 163' ' ' LEU . 37.1 m-85 -75.28 -29.06 60.0 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.642 -179.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 74.3 m -54.44 -40.71 68.6 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.979 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -136.09 -41.66 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -59.4 134.85 51.71 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.587 -0.816 . . . . 0.0 112.167 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 80.5 p -59.23 129.27 41.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.911 0.386 . . . . 0.0 111.137 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.501 HG22 ' H ' ' A' ' 159' ' ' ASP . 98.4 m -164.42 -40.27 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.673 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 157' ' ' THR . 63.4 tttp 70.48 -24.87 0.16 Allowed 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 179.125 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.501 ' H ' HG22 ' A' ' 157' ' ' THR . 32.0 m-20 -72.99 60.5 0.54 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.541 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 45.7 ttt85 -54.5 -29.47 50.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.672 -0.24 . . . . 0.0 111.255 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -53.32 -46.77 69.56 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.036 0.446 . . . . 0.0 110.523 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 98.8 mt -61.02 -36.39 79.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.004 179.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.605 HD13 ' HB2' ' A' ' 152' ' ' TYR . 39.9 tp -57.37 -46.42 83.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.104 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.54 -42.75 75.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.417 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.568 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.7 m -57.19 -42.74 81.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.819 179.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -71.0 -35.83 72.22 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.297 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 13.0 mm-40 -56.92 -48.82 77.37 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.991 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 165' ' ' THR . 19.4 pt20 -65.45 -41.37 93.49 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.162 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.568 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.8 mtm -59.51 -38.18 80.26 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-O 120.865 0.364 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.477 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.3 tm? -61.6 -45.43 94.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.422 179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -59.8 -50.85 72.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.039 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -62.17 -39.55 93.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.025 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 43.1 t -56.86 -44.75 82.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.82 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.48 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 55.9 mtpt -61.06 -44.54 97.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.625 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -56.03 -41.69 75.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.903 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -61.88 -45.52 93.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.05 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.546 HG12 ' CD ' ' A' ' 138' ' ' GLU . 28.5 mt -57.85 -41.78 80.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.942 -179.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -63.59 -49.31 73.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.754 0.311 . . . . 0.0 111.435 -179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 64.6 mt -62.12 -50.29 80.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.32 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -59.13 -43.97 90.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.822 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.3 ttp180 -53.55 -41.09 66.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.273 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.429 ' SD ' ' HD3' ' A' ' 185' ' ' ARG . 48.0 tpp -62.62 -38.24 89.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.306 179.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.69 -44.09 94.7 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.861 -0.608 . . . . 0.0 111.259 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.559 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -58.36 -55.27 37.22 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.707 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.496 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 16.0 ptm180 -58.85 -38.63 79.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.727 0.299 . . . . 0.0 110.594 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.508 ' HD3' ' O ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -57.74 -40.45 79.68 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.304 179.739 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.35 -46.09 90.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.19 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.41 HD23 ' O ' ' A' ' 184' ' ' LEU . 4.1 mm? -64.28 -41.66 96.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.41 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.496 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 72.8 mt-30 -59.41 -48.03 83.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.748 0.309 . . . . 0.0 111.056 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.09 -43.14 88.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.254 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -61.06 -38.7 87.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.289 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 192' ' ' GLN . 8.1 tt0 -78.04 46.16 0.57 Allowed 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.155 -179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.469 HD13 ' N ' ' A' ' 194' ' ' GLU . 2.0 tm? -175.82 122.68 0.19 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.126 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.505 ' HG3' ' H ' ' A' ' 195' ' ' ASN . 31.0 tp10 -76.49 -128.23 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.534 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.505 ' H ' ' HG3' ' A' ' 194' ' ' GLU . 45.4 t30 -177.94 -50.73 0.01 OUTLIER 'General case' 0 C--O 1.231 0.093 0 CA-C-O 120.863 0.363 . . . . 0.0 110.539 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -71.29 139.51 49.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.0 179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.08 130.34 45.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -174.25 137.64 0.65 Allowed Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.979 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 C--O 1.249 1.044 0 C-N-CA 122.569 2.179 . . . . 0.0 112.236 179.839 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 12.4 tt -174.16 132.37 0.53 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-O 120.616 0.246 . . . . 0.0 110.864 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -58.48 -53.76 3.68 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.512 2.141 . . . . 0.0 112.126 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.664 ' HB3' HD11 ' A' ' 125' ' ' LEU . . . -72.07 144.03 48.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.861 179.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 81.1 p -53.74 -50.22 66.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.381 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.438 ' C ' HD12 ' A' ' 125' ' ' LEU . 49.6 t30 -178.33 140.11 0.21 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.79 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.664 HD11 ' HB3' ' A' ' 122' ' ' ALA . 4.0 mp -125.26 -33.09 2.89 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.229 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 77.9 p -47.55 -42.93 24.53 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.851 -179.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.488 ' NE ' ' HA ' ' A' ' 127' ' ' ARG . 6.5 tpm_? -65.46 -47.0 77.63 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.511 -179.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 89.6 t -63.53 -52.57 56.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.898 0.38 . . . . 0.0 111.54 -179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.5 -38.77 85.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.505 -179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.552 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.41 -44.42 97.64 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.572 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.533 ' HB3' HD21 ' A' ' 184' ' ' LEU . 94.8 mt -67.88 -41.0 83.48 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.851 0.358 . . . . 0.0 111.074 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 95.3 mt-10 -64.18 -49.19 73.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.537 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.463 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -57.2 -39.48 75.48 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.765 0.317 . . . . 0.0 110.608 -179.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.552 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 95.0 mm-40 -58.29 -46.07 86.79 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.562 179.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 95.5 mt -54.62 -44.48 73.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.097 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.14 -43.03 99.51 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.345 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.9 mt -59.74 -48.82 86.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.317 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.428 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.0 OUTLIER -55.67 -45.38 77.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.694 179.999 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 48.0 mt -62.35 -38.51 89.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.015 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -63.01 -42.81 99.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.951 0.405 . . . . 0.0 110.479 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.69 -46.36 82.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.208 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.739 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 38.9 ttmt -61.01 -49.47 77.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.898 -179.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -62.34 -43.55 98.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.449 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -59.68 -36.26 89.03 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.8 -0.714 . . . . 0.0 111.883 179.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.524 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.17 -41.77 80.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.96 0.409 . . . . 0.0 110.568 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.484 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.4 mt-10 -60.06 -44.57 94.63 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.999 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.544 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 19.3 t-20 -61.8 -44.86 96.03 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.554 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.471 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.5 mtp -61.0 -40.76 94.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 145' ' ' ALA . 85.3 mt -61.21 -51.07 77.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.248 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.544 ' HG3' ' O ' ' A' ' 147' ' ' ASN . 4.0 pp0? -66.85 -30.47 70.66 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.713 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 82.7 m -64.59 -50.61 66.55 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.712 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -63.54 -36.7 84.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.86 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 47.5 t -53.58 -40.2 65.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.384 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -59.85 156.5 14.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.468 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -47.26 -45.49 21.34 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.981 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 48.2 t -70.81 122.18 19.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.574 0.226 . . . . 0.0 111.015 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 84.9 m 61.66 133.64 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.553 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.58 ' NZ ' ' HB2' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -173.54 42.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.276 179.741 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.78 130.91 47.01 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.419 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.1 mmm180 -68.2 -44.66 75.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.581 -179.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.525 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 8.4 ptpp? -57.82 -47.82 81.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.751 0.31 . . . . 0.0 110.973 -179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 96.6 mt -70.95 -35.92 72.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.819 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.501 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 61.1 tp -57.03 -51.26 69.98 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.094 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 165' ' ' THR . 4.2 pp -65.03 -38.52 91.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.902 0.382 . . . . 0.0 110.555 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.627 ' N ' HD12 ' A' ' 164' ' ' LEU . 89.7 m -55.63 -45.19 77.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.46 179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -63.71 -40.68 97.37 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.325 179.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.501 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.6 mt-30 -59.14 -41.65 88.79 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.934 179.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.9 tp60 -60.69 -41.28 94.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.96 179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.6 mtp -59.71 -47.48 85.48 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.477 179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.546 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 60.7 tp -57.03 -44.47 82.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.854 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.564 ' HA ' ' NZ ' ' A' ' 174' ' ' LYS . 8.3 tt0 -61.64 -43.14 99.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.081 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.41 -43.93 96.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.417 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.5 ' O ' HG13 ' A' ' 177' ' ' ILE . 89.3 p -62.29 -45.58 92.62 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.435 -179.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.739 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 10.4 mtmp? -57.66 -49.64 75.81 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.6 m -55.73 -43.34 76.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.282 -179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -61.93 -41.01 97.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.072 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 173' ' ' SER . 64.1 mt -58.48 -41.07 80.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.025 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -64.6 -46.15 83.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.184 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.582 ' O ' ' HG2' ' A' ' 182' ' ' MET . 51.0 mm -62.93 -43.87 99.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.08 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.6 ' O ' HD23 ' A' ' 184' ' ' LEU . 72.9 mt -65.64 -40.73 88.84 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.917 0.389 . . . . 0.0 110.501 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.507 ' HE ' ' NH2' ' A' ' 185' ' ' ARG . 78.4 ttt180 -52.06 -52.11 53.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.393 -179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.582 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 21.2 ptp -62.79 -39.77 95.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.566 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 86.4 mt-30 -55.27 -43.88 75.11 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.717 0.294 . . . . 0.0 110.483 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.6 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.4 mm? -61.53 -39.28 90.48 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.507 ' NH2' ' HE ' ' A' ' 181' ' ' ARG . 21.5 mmt85 -55.85 -58.16 9.02 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.417 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.439 HH11 ' HG2' ' A' ' 186' ' ' ARG . 0.6 OUTLIER -67.23 -32.78 74.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.406 179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.19 -43.54 95.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.93 0.395 . . . . 0.0 111.044 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 99.1 mt -69.96 -45.34 67.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.365 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 3.2 mm100 -62.02 -46.68 88.12 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.652 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.04 -47.97 75.5 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.604 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -61.66 -48.98 78.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.917 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.415 HE21 ' HB3' ' A' ' 188' ' ' LEU . 74.0 mt-30 -69.08 -115.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.091 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 31.5 tp 64.48 41.11 5.81 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-O 121.157 0.503 . . . . 0.0 110.348 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 194' ' ' GLU . 37.4 tt0 -177.84 35.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.035 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.537 HD22 ' H ' ' A' ' 196' ' ' GLN . 0.8 OUTLIER -178.05 135.28 0.16 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.486 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.537 ' H ' HD22 ' A' ' 195' ' ' ASN . 70.8 mt-30 -57.6 133.91 55.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.55 139.14 57.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.165 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.435 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . -169.54 137.13 1.48 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.044 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 37.5 Cg_exo . . . . . 0 C--O 1.249 1.075 0 C-N-CA 122.601 2.201 . . . . 0.0 112.262 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 48.7 mt 58.13 66.43 2.7 Favored Pre-proline 0 CA--C 1.53 0.211 0 CA-C-O 120.761 0.315 . . . . 0.0 110.886 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.426 ' HB2' ' H ' ' A' ' 122' ' ' ALA . 47.7 Cg_endo -67.5 -135.51 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.6 2.2 . . . . 0.0 112.247 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.426 ' H ' ' HB2' ' A' ' 121' ' ' PRO . . . -57.84 -46.14 85.2 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.764 0.316 . . . . 0.0 111.072 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.403 HG22 ' HG2' ' A' ' 121' ' ' PRO . 5.9 t -63.57 126.81 28.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.051 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 44.8 t30 179.17 -41.52 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.379 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 87.9 mt -57.06 -37.41 71.8 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.831 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.4 t -59.83 -40.67 89.28 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.801 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.457 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 15.5 tpp85 -66.88 -48.81 67.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.316 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 80.1 t -61.85 -54.85 29.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.363 -179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.83 -38.07 86.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.104 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.601 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.23 -45.27 96.38 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.524 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.58 ' HB3' HD21 ' A' ' 184' ' ' LEU . 93.3 mt -67.88 -43.9 78.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.709 0.29 . . . . 0.0 111.155 -179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 58.4 mm-40 -60.11 -48.27 82.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.672 -179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.467 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -60.19 -40.81 91.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.179 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.601 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.8 mm100 -56.68 -45.01 82.01 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.692 0.282 . . . . 0.0 110.923 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 61.9 tp -60.12 -42.73 95.4 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.893 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.68 -44.74 96.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.03 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 133' ' ' LYS . 67.8 mt -59.47 -42.3 87.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.657 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.8 mm-40 -58.59 -43.98 89.67 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 94.2 mt -60.11 -38.26 82.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.898 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.498 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 13.0 tmtt? -63.59 -52.85 59.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.228 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.1 -45.27 87.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.748 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.423 ' HE2' ' HD3' ' A' ' 174' ' ' LYS . 62.8 tttm -58.05 -45.77 86.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.056 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -64.06 -47.91 78.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.195 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -61.31 -32.16 79.8 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.822 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.644 ' O ' HG12 ' A' ' 149' ' ' ILE . . . -66.17 -43.99 85.32 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 120.946 0.403 . . . . 0.0 110.105 179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.6 mt-10 -58.96 -40.83 85.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.343 179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -58.5 -42.63 88.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 83.5 mtp -66.4 -45.85 78.6 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.604 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 145' ' ' ALA . 43.0 mm -54.65 -42.91 63.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.688 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.62 -41.78 65.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.188 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 67.2 m -56.71 -52.86 63.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.86 -179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.414 ' HA ' ' O ' ' A' ' 157' ' ' THR . 24.8 m-85 -71.78 -42.68 66.84 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.942 -179.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 41.3 t -54.89 120.9 7.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 20.7 p30 46.52 -164.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.043 -179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 45.68 46.47 13.07 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.78 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.492 ' HA ' ' HE3' ' A' ' 158' ' ' LYS . 36.3 t 62.62 179.09 0.14 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.7 0.286 . . . . 0.0 110.925 -179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.414 ' O ' ' HA ' ' A' ' 152' ' ' TYR . 77.3 p 51.06 38.64 21.21 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.676 179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.875 ' HD2' ' H ' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -88.49 45.96 1.34 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.359 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 163' ' ' LEU . 56.2 m-20 -57.8 127.13 30.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.672 0.272 . . . . 0.0 110.508 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.401 HH11 ' HG3' ' A' ' 160' ' ' ARG . 20.9 mmt85 -71.08 -47.71 56.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.824 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -55.14 -50.89 68.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.794 0.33 . . . . 0.0 111.234 -179.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.408 HD22 ' N ' ' A' ' 162' ' ' LEU . 3.8 mm? -70.07 -35.61 74.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.112 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.456 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 62.1 tp -54.66 -49.2 71.17 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.858 0.361 . . . . 0.0 110.394 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.9 mt -67.04 -35.8 80.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.38 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.6 m -57.59 -47.85 81.0 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.257 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.56 -46.54 75.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.089 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 85.4 mt-30 -56.8 -36.99 70.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.154 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.2 tp60 -64.24 -44.24 92.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.821 179.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.427 ' HG3' ' O ' ' A' ' 165' ' ' THR . 39.1 mtm -63.2 -42.39 99.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.888 0.375 . . . . 0.0 110.424 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 49.1 tp -61.22 -46.23 91.3 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.92 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -61.09 -44.5 97.27 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.287 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -57.74 -43.26 85.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.848 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.555 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.0 m -63.13 -43.32 98.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.061 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.4 mmmm -56.07 -51.91 66.15 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.516 -179.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 87.3 m -56.41 -45.87 80.47 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.679 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 180' ' ' ILE . 34.4 mmtp -62.84 -41.81 99.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.487 -179.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.657 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -59.99 -40.16 82.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.355 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.6 -46.06 90.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.681 ' O ' ' HG3' ' A' ' 182' ' ' MET . 67.0 mt -63.22 -44.15 99.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 120.928 0.394 . . . . 0.0 110.761 179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.579 ' O ' HD23 ' A' ' 184' ' ' LEU . 69.7 mt -63.99 -38.2 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.897 0.38 . . . . 0.0 110.369 179.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.433 ' HG3' HH11 ' A' ' 181' ' ' ARG . 40.3 ttt85 -54.93 -49.27 71.73 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.251 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.681 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 4.5 ppp? -65.54 -32.9 74.74 Favored 'General case' 0 C--O 1.233 0.197 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.456 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.564 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 73.3 mt-30 -61.03 -47.25 87.28 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.851 0.357 . . . . 0.0 110.576 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.58 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.3 mm? -60.19 -43.92 95.5 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.669 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 48.3 mtp85 -54.44 -44.19 72.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.601 179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -63.79 -36.21 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.917 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.41 -45.43 93.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.018 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.532 ' O ' ' HG3' ' A' ' 192' ' ' GLN . 9.6 mp -65.81 -43.31 89.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.862 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 73.3 mt-30 -55.85 -45.59 78.4 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.907 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.69 98.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.993 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -63.8 -38.15 90.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.979 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.532 ' HG3' ' O ' ' A' ' 188' ' ' LEU . 24.8 mt-30 -58.81 -51.61 69.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.34 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -66.46 -50.5 63.13 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.786 0.326 . . . . 0.0 111.126 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -64.98 130.44 43.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.812 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 14.2 p-10 -64.62 142.09 58.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.719 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -57.1 131.58 50.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.671 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.09 133.51 54.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.285 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.514 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -173.78 56.0 0.19 Allowed Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.273 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.514 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 41.9 Cg_exo . . . . . 0 C--O 1.25 1.114 0 C-N-CA 122.424 2.083 . . . . 0.0 112.311 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.176 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.854 HD12 ' HD2' ' A' ' 121' ' ' PRO . 6.6 tp -60.94 120.62 55.54 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 0.0 110.999 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.854 ' HD2' HD12 ' A' ' 120' ' ' ILE . 83.0 Cg_endo -80.97 46.26 2.22 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 122.663 2.242 . . . . 0.0 112.874 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -170.73 31.77 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 70.0 p 55.79 149.16 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.268 0.556 . . . . 0.0 112.311 179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.406 ' N ' HD22 ' A' ' 124' ' ' ASN . 2.6 m120 -57.01 135.4 56.28 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.36 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 95.3 mt -146.36 -42.05 0.2 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.141 -179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 43.0 t -56.83 -46.38 81.73 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.05 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.419 ' HG2' HH11 ' A' ' 127' ' ' ARG . 55.1 ttp85 -63.3 -53.08 58.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.918 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.406 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 72.6 t -47.51 -48.71 10.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.532 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.06 -37.23 81.92 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.057 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.583 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -60.2 -58.18 15.34 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.538 179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 1.017 HD23 HD22 ' A' ' 184' ' ' LEU . 7.0 mp -53.25 -43.31 67.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.681 0.277 . . . . 0.0 111.71 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.3 mt-10 -64.36 -50.53 67.37 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 23.2 pttm -59.94 -37.92 80.92 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.698 0.285 . . . . 0.0 111.023 -179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.1 mm100 -59.22 -48.79 80.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.296 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 88.0 mt -57.64 -44.14 85.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.636 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . 0.451 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -60.93 -49.7 76.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.056 -179.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.83 -48.75 86.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.963 -179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.582 ' OE2' HD11 ' A' ' 180' ' ' ILE . 0.3 OUTLIER -59.33 -45.4 91.45 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.325 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 86.7 mt -58.66 -41.47 86.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.568 0.223 . . . . 0.0 111.398 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.451 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 62.1 mttp -61.81 -49.71 75.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.378 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.36 -46.67 83.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 111.382 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.8 tttt -57.25 -47.35 81.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.051 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -59.07 -42.65 90.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.669 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.04 -37.65 94.9 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.188 179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.447 ' HB1' ' HB2' ' A' ' 170' ' ' LEU . . . -66.27 -41.17 90.24 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.1 0.476 . . . . 0.0 110.243 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -63.33 -39.35 94.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.44 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.32 -44.61 88.73 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.064 179.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.429 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 18.7 mmt -63.64 -48.33 77.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.142 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 145' ' ' ALA . 69.6 mt -55.19 -45.43 77.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.792 0.33 . . . . 0.0 111.086 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -65.99 -39.7 90.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.091 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.5 m -65.37 -52.32 54.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.708 -179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.429 ' HD1' ' O ' ' A' ' 148' ' ' MET . 10.0 m-85 -75.61 17.61 0.28 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.608 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.2 t -71.78 -46.41 58.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.774 0.321 . . . . 0.0 110.825 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.432 ' HA ' ' CE ' ' A' ' 158' ' ' LYS . 43.4 t30 -176.22 133.73 0.24 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.944 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 67.72 155.73 0.62 Allowed Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.825 179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 95.1 p 54.68 74.64 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.78 0.324 . . . . 0.0 111.514 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 88.7 m 67.79 140.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.496 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.432 ' CE ' ' HA ' ' A' ' 154' ' ' ASN . 40.3 ttmt -165.8 50.06 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.569 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.579 ' OD2' HD13 ' A' ' 162' ' ' LEU . 64.1 t0 -61.26 129.21 40.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.372 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 23.6 tpp180 -66.98 -43.71 82.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.447 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -57.57 -54.11 50.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.325 -179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.579 HD13 ' OD2' ' A' ' 159' ' ' ASP . 10.9 mp -66.11 -30.68 71.22 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.195 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.468 ' HG ' HE21 ' A' ' 167' ' ' GLN . 63.3 tp -55.66 -52.55 63.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.886 0.374 . . . . 0.0 110.464 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.466 ' O ' ' HG2' ' A' ' 168' ' ' GLN . 87.3 mt -69.56 -37.14 76.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.491 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.45 ' O ' ' HG3' ' A' ' 169' ' ' MET . 94.6 m -55.52 -44.66 76.85 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.841 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.95 -44.49 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.564 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.468 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.3 mt-30 -58.29 -38.11 76.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.149 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 94.5 mm-40 -63.62 -42.72 98.15 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.037 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.45 ' HG3' ' O ' ' A' ' 165' ' ' THR . 43.6 mtm -64.17 -40.43 96.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.778 179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 49.3 tp -62.55 -42.88 99.82 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.984 -179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -58.79 -45.39 89.99 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.767 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -60.61 -41.46 94.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.727 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.453 ' O ' HG13 ' A' ' 177' ' ' ILE . 49.7 m -62.05 -42.35 99.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.945 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.7 mtpp -57.91 -44.38 86.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.004 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 92.2 m -61.0 -46.11 92.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.865 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.568 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.0 mtpp -59.89 -47.87 84.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.853 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.777 ' HA ' HD12 ' A' ' 180' ' ' ILE . 64.7 mt -60.23 -35.77 64.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.962 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . 0.58 ' HA ' ' CZ ' ' A' ' 181' ' ' ARG . 30.4 t70 -57.72 -49.41 76.63 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.404 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 42.3 mm -60.65 -39.29 81.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.4 179.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.777 HD12 ' HA ' ' A' ' 177' ' ' ILE . 66.2 mt -56.39 -53.67 37.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.718 179.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.603 HH11 HG22 ' A' ' 177' ' ' ILE . 78.3 mtm-85 -52.38 -39.38 60.74 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.487 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 64.9 mtt -57.87 -40.2 79.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.434 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -70.37 -41.74 72.7 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.222 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 1.017 HD22 HD23 ' A' ' 131' ' ' LEU . 4.4 mm? -61.11 -51.71 67.94 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.504 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 181' ' ' ARG . 16.9 ptm180 -59.29 -45.09 92.2 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.185 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.422 ' HA ' ' OE1' ' A' ' 189' ' ' GLN . 79.4 ttt180 -63.72 -35.75 81.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.098 0.475 . . . . 0.0 110.565 179.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -67.39 -38.79 85.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.324 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 89.3 mt -65.79 -51.67 57.13 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.897 -179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.422 ' OE1' ' HA ' ' A' ' 186' ' ' ARG . 2.7 pt20 -56.39 -46.13 80.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.894 0.378 . . . . 0.0 111.666 -179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.13 -40.9 82.37 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.401 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -60.82 -39.14 87.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.799 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.509 ' HG3' ' O ' ' A' ' 188' ' ' LEU . 26.3 mt-30 -54.84 -41.96 71.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.038 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.469 ' O ' HD13 ' A' ' 193' ' ' LEU . 2.2 tm? -62.67 -49.77 73.81 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.179 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -74.02 -147.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.78 179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -177.87 127.22 0.13 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.858 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 25.6 pt20 -76.89 132.02 38.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.886 179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -67.17 131.33 45.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.066 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 63.7 137.11 0.04 OUTLIER Pre-proline 0 CA--C 1.529 0.161 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.518 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo . . . . . 0 C--O 1.249 1.054 0 C-N-CA 122.45 2.1 . . . . 0.0 112.229 179.839 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 49.2 mm -61.14 125.48 83.94 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-O 120.506 0.193 . . . . 0.0 111.05 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.717 ' HG2' HG23 ' A' ' 123' ' ' THR . 80.2 Cg_endo -79.43 42.98 1.4 Allowed 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.566 2.177 . . . . 0.0 112.548 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.825 ' HB1' HD11 ' A' ' 125' ' ' LEU . . . 59.38 41.81 19.0 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.783 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.717 HG23 ' HG2' ' A' ' 121' ' ' PRO . 53.8 p -87.49 -45.25 10.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.156 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.436 ' HA ' ' NH2' ' A' ' 127' ' ' ARG . 5.0 m120 -78.52 49.56 0.88 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.407 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.825 HD11 ' HB1' ' A' ' 122' ' ' ALA . 88.1 mt -93.09 -46.31 7.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.7 0.286 . . . . 0.0 111.619 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.5 m -66.77 -49.79 64.79 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -178.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.436 ' NH2' ' HA ' ' A' ' 124' ' ' ASN . 62.2 mtm-85 -61.14 -48.0 83.62 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.46 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 96.2 t -65.34 -48.82 81.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-O 120.716 0.294 . . . . 0.0 111.773 -179.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.23 -39.6 83.28 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.325 -179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.58 -46.03 95.12 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.535 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 184' ' ' LEU . 82.8 mt -65.61 -43.67 88.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.828 0.347 . . . . 0.0 111.093 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -60.64 -50.84 71.91 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.867 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.45 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 22.1 ptmt -57.93 -38.82 76.63 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.559 0.218 . . . . 0.0 110.907 -179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.593 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.0 mm-40 -57.92 -45.33 86.7 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.803 0.335 . . . . 0.0 110.66 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.519 ' HA ' ' CD ' ' A' ' 138' ' ' GLU . 60.5 tp -60.27 -38.34 83.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.271 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -65.02 -46.6 80.63 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.07 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 66.8 mt -64.57 -49.09 82.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -178.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.677 ' OE1' HG13 ' A' ' 180' ' ' ILE . 7.6 pt-20 -57.89 -44.8 86.95 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.1 mt -59.89 -42.17 93.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.752 0.311 . . . . 0.0 110.943 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -59.39 -45.26 91.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.02 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.3 t -65.86 -45.94 90.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.667 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.672 ' HE2' ' HG2' ' A' ' 174' ' ' LYS . 40.2 ttmt -60.16 -48.7 80.63 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.679 0.276 . . . . 0.0 111.107 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.31 -43.4 98.91 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.856 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.412 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.2 -37.86 94.68 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.335 179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.516 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.37 -42.88 82.69 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.96 0.41 . . . . 0.0 110.417 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.48 -41.22 98.63 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.736 179.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -58.07 -45.66 86.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.613 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 92.0 mmm -65.6 -46.04 80.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.936 179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 145' ' ' ALA . 87.4 mt -55.79 -46.24 79.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.181 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 72.9 mt-30 -62.16 -41.2 98.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.004 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 90.0 m -64.79 -37.74 88.62 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.584 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.5 m-30 -75.25 -34.39 61.38 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.244 -0.434 . . . . 0.0 112.109 -179.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 89.2 p -60.31 -48.23 82.62 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 11.3 p-10 -65.04 -157.74 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -67.75 -55.83 13.15 Favored Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.487 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.5 t -59.43 123.63 17.41 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.775 0.288 . . . . 0.0 110.523 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 91.0 m 63.11 140.17 0.02 OUTLIER 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.921 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -166.14 36.53 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.812 0.339 . . . . 0.0 111.461 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.6 ' OD1' ' HB3' ' A' ' 162' ' ' LEU . 1.3 p30 -68.79 130.83 43.93 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.549 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.618 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 41.3 mmm-85 -74.52 -55.72 5.63 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.617 ' NZ ' ' HB2' ' A' ' 161' ' ' LYS . 0.0 OUTLIER -59.74 -50.94 71.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -178.599 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.6 ' HB3' ' OD1' ' A' ' 159' ' ' ASP . 60.7 tp -59.8 -43.41 94.46 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 120.494 0.188 . . . . 0.0 111.104 -179.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 61.3 tp -59.11 -40.4 85.23 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 160' ' ' ARG . 93.9 mt -54.79 -42.71 72.11 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.065 179.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 93.2 m -57.42 -46.02 83.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.262 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.05 -40.15 94.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.797 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 96.8 mm-40 -57.27 -47.27 81.84 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.407 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -62.42 -38.33 89.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.021 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 69.0 mmm -59.92 -46.52 89.1 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.284 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.509 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -56.48 -46.97 80.16 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.539 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.2 tt0 -62.88 -42.64 99.84 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.961 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -61.71 -43.74 98.27 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.917 -179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 48.7 m -58.22 -43.94 87.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.113 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.672 ' HG2' ' HE2' ' A' ' 142' ' ' LYS . 7.5 mtpm? -59.2 -44.22 92.23 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.739 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . 0.404 ' O ' HG12 ' A' ' 179' ' ' ILE . 87.9 m -57.49 -43.53 84.2 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.574 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 7.9 mtpm? -56.99 -49.68 75.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.722 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.589 HD12 ' NZ ' ' A' ' 142' ' ' LYS . 56.4 mt -57.9 -41.08 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.184 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -59.09 -45.96 89.52 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.889 0.376 . . . . 0.0 110.586 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 175' ' ' THR . 51.2 mm -58.53 -39.68 76.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.384 179.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.677 HG13 ' OE1' ' A' ' 138' ' ' GLU . 46.9 mm -60.68 -47.32 93.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.855 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.486 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.0 tpt85 -52.9 -42.13 65.03 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.186 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -60.93 -42.32 97.94 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.554 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -61.1 -46.11 91.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.614 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.697 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -57.84 -42.27 84.04 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.868 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.486 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 51.2 mtp85 -59.9 -46.37 89.54 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.879 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 47.6 mtp85 -60.93 -37.76 83.43 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.083 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.68 -48.23 80.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.09 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 82.1 mt -60.95 -43.98 97.92 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.2 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.7 mt-30 -62.16 -42.04 98.88 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.375 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -59.97 -47.88 83.99 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.608 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.07 -47.15 81.68 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.753 0.311 . . . . 0.0 110.587 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -66.23 134.14 52.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.175 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 1.7 tt 59.55 50.19 7.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.156 0.503 . . . . 0.0 109.823 -179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 89.2 tt0 -70.03 -44.91 68.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.171 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -58.9 128.72 38.61 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.957 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -72.64 135.29 45.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.865 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.33 133.26 53.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.039 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -173.07 137.3 0.77 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.026 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo . . . . . 0 C--O 1.249 1.058 0 C-N-CA 122.582 2.188 . . . . 0.0 112.269 -179.894 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.506 HG12 ' H ' ' A' ' 122' ' ' ALA . 12.1 tt -173.54 133.46 0.61 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-O 120.67 0.271 . . . . 0.0 110.961 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.452 ' HD2' HG13 ' A' ' 120' ' ' ILE . 21.0 Cg_endo -60.9 -34.18 91.47 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.772 2.315 . . . . 0.0 112.657 -179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.506 ' H ' HG12 ' A' ' 120' ' ' ILE . . . -52.58 -50.43 63.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.711 -179.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.437 ' O ' ' HB3' ' A' ' 124' ' ' ASN . 81.0 p -74.07 -145.73 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.247 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.437 ' HB3' ' O ' ' A' ' 123' ' ' THR . 50.1 t30 73.81 -44.37 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.67 179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 98.7 mt -61.29 -39.9 92.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.634 0.254 . . . . 0.0 111.086 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 51.0 m -56.81 -43.38 80.93 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.906 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -65.14 -44.61 88.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 82.7 t -61.03 -57.15 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.6 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.43 -41.73 90.27 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.562 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.837 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -61.16 -47.67 89.84 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.909 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.56 ' HB3' ' CD2' ' A' ' 184' ' ' LEU . 82.8 mt -67.51 -41.34 84.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.666 0.27 . . . . 0.0 111.535 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -61.76 -47.65 84.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.776 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.837 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.8 pttt -60.08 -42.35 94.43 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.81 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HB3' HD13 ' A' ' 180' ' ' ILE . 97.7 mm-40 -61.04 -40.5 93.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.864 0.364 . . . . 0.0 110.816 179.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.522 ' C ' HD13 ' A' ' 135' ' ' LEU . 3.4 tm? -58.62 -46.42 87.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.248 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . 0.506 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -66.79 -45.95 76.81 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.207 -0.451 . . . . 0.0 112.07 -179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.559 ' O ' HG23 ' A' ' 141' ' ' VAL . 71.2 mt -60.96 -48.62 88.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.3 0.481 . . . . 0.0 112.3 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.65 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.3 pt-20 -59.78 -43.82 94.21 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.585 HD23 HD13 ' A' ' 177' ' ' ILE . 84.0 mt -59.29 -45.16 92.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.684 0.278 . . . . 0.0 110.984 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.602 ' HB3' ' NZ ' ' A' ' 140' ' ' LYS . 8.1 mtpm? -59.73 -42.91 94.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.933 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.6 t -62.41 -40.55 88.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.734 179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 86.3 tttt -61.35 -49.04 78.55 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.97 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 69.9 tp60 -61.43 -44.39 97.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.85 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.536 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.17 -38.42 95.58 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.638 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.51 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.47 -41.51 84.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.976 0.417 . . . . 0.0 110.765 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 96.2 mt-10 -59.53 -44.14 93.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.021 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.85 -44.42 97.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.547 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.536 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 91.9 mmm -64.3 -42.7 96.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.238 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.561 HD11 ' HA ' ' A' ' 167' ' ' GLN . 88.8 mt -62.63 -47.78 91.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.406 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 84.6 mt-30 -63.52 -44.94 92.82 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.182 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 94.5 m -62.5 -49.43 75.38 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.68 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.505 ' HA ' ' CG2' ' A' ' 157' ' ' THR . 2.7 m-30 -64.29 -43.86 93.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.691 -179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 61.0 m -78.41 48.71 0.79 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.297 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.571 ' ND2' ' H ' ' A' ' 155' ' ' GLY . 39.2 t30 -166.14 -138.59 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 121.104 -0.238 . . . . 0.0 111.137 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . 0.571 ' H ' ' ND2' ' A' ' 154' ' ' ASN . . . -89.13 160.0 29.24 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 121.142 -0.551 . . . . 0.0 113.719 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 37.7 t 63.85 24.99 13.92 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 122.685 0.394 . . . . 0.0 111.673 179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.505 ' CG2' ' HA ' ' A' ' 152' ' ' TYR . 28.3 m -170.34 147.14 3.0 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.689 179.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -156.93 22.26 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.853 0.358 . . . . 0.0 111.124 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 56.5 m-20 -75.74 90.92 2.89 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.505 179.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 48.1 mmt-85 -65.18 -45.24 85.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.481 -179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 22.0 pttp -57.96 -48.36 80.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.77 0.319 . . . . 0.0 110.775 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.416 ' N ' ' HG3' ' A' ' 161' ' ' LYS . 90.7 mt -64.53 -37.68 88.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.368 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 62.8 tp -58.51 -42.66 88.16 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.43 179.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.498 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 85.1 mt -63.05 -38.73 92.36 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.402 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 90.0 m -65.43 -41.74 93.21 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.888 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -65.91 -48.63 70.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.597 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.561 ' HA ' HD11 ' A' ' 149' ' ' ILE . 3.2 pt20 -58.24 -38.57 77.14 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.928 0.394 . . . . 0.0 110.077 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -63.09 -39.98 96.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.827 179.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 68.5 mtp -61.58 -46.33 90.33 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.813 179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.513 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 56.2 tp -57.02 -46.1 82.6 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.286 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -60.87 -46.8 89.15 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -61.22 -42.42 98.57 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.093 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.546 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.6 m -62.86 -49.74 73.65 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.429 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.9 mtpp -57.14 -43.24 82.26 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.011 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.1 m -59.01 -47.42 85.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.94 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 48.5 mmtm -58.3 -40.21 81.36 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.889 179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.585 HD13 HD23 ' A' ' 139' ' ' LEU . 53.0 mt -59.74 -39.78 80.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.259 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -62.47 -53.13 59.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.279 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -62.48 -56.15 19.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.084 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.65 HD12 ' OE1' ' A' ' 138' ' ' GLU . 68.0 mt -52.7 -40.24 33.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.627 179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.587 ' HD3' HD12 ' A' ' 184' ' ' LEU . 15.6 tpp85 -54.77 -43.95 73.23 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.984 0.421 . . . . 0.0 110.081 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 91.2 mmm -57.32 -43.7 83.55 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.458 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.8 mp0 -67.32 -32.27 73.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.276 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.587 HD12 ' HD3' ' A' ' 181' ' ' ARG . 20.7 mt -57.09 -57.13 13.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.252 0.549 . . . . 0.0 110.663 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.508 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 14.7 ptp180 -62.6 -41.57 99.06 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.182 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.549 ' HD2' ' O ' ' A' ' 186' ' ' ARG . 4.7 tmm_? -59.22 -40.27 85.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.846 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -67.47 -45.87 74.66 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.565 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.519 ' HA ' ' OD2' ' A' ' 191' ' ' ASP . 79.7 mt -60.25 -48.14 83.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.972 -179.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 15.6 pt20 -62.1 -45.06 95.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.942 0.401 . . . . 0.0 111.419 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -61.68 -52.07 65.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.193 -178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . 0.519 ' OD2' ' HA ' ' A' ' 188' ' ' LEU . 3.0 p30 -61.79 -27.95 69.11 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.896 0.379 . . . . 0.0 110.413 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -76.68 54.08 0.94 Allowed 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.607 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 193' ' ' LEU . 2.9 tm? -164.16 -43.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.074 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 58.59 -126.63 1.44 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.905 179.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -155.28 -40.27 0.09 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.806 0.336 . . . . 0.0 110.537 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 25.9 mt-30 -57.3 136.3 56.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.859 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.14 135.05 57.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.305 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -64.04 137.57 97.15 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.191 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 C--O 1.249 1.033 0 C-N-CA 122.556 2.17 . . . . 0.0 112.207 -179.974 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.484 -0.247 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.545 ' N ' HD12 ' A' ' 120' ' ' ILE . 2.6 mp -65.18 131.75 95.16 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.565 0.222 . . . . 0.0 110.74 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 22.7 Cg_exo -65.41 -148.04 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.684 2.256 . . . . 0.0 112.724 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -80.12 64.59 5.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.572 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.9 t -158.58 140.07 13.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 111.356 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.6 m120 60.76 37.91 18.53 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.042 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 95.9 mt -82.49 -47.15 12.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.966 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 52.5 m -63.24 -33.45 75.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.338 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.576 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 5.5 tpm_? -58.35 -49.79 75.94 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.475 -179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.2 t -65.49 -51.51 62.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.66 -43.51 93.92 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.921 -178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.593 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.79 -49.67 66.7 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.827 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 184' ' ' LEU . 98.1 mt -65.74 -44.85 84.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.831 0.348 . . . . 0.0 111.083 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -56.81 -50.8 71.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.627 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 15.0 ptmm? -58.71 -36.63 74.56 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.414 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.715 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.5 mm100 -56.2 -45.22 79.9 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.509 179.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 4.5 mm? -58.74 -41.18 85.85 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.065 0.46 . . . . 0.0 110.485 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.3 -40.1 89.29 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.935 179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.7 mt -66.46 -49.53 74.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.053 -0.522 . . . . 0.0 112.127 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.494 ' OE2' ' HG ' ' A' ' 139' ' ' LEU . 1.4 pp20? -60.19 -43.32 96.0 Favored 'General case' 0 CA--C 1.52 -0.179 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.464 -179.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.494 ' HG ' ' OE2' ' A' ' 138' ' ' GLU . 93.1 mt -56.54 -45.31 81.24 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.82 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -62.39 -47.06 85.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 137' ' ' ILE . 61.5 t -64.93 -40.83 90.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.424 -179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.488 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 61.8 tttm -62.21 -50.21 72.7 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.173 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -64.01 -44.89 91.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.763 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.455 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -63.15 -34.78 90.89 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 121.05 -0.595 . . . . 0.0 112.534 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.515 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -68.07 -42.48 80.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.952 0.406 . . . . 0.0 110.799 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.4 mt-10 -60.7 -43.59 97.58 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.838 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -60.99 -41.36 96.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.579 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.455 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.2 mtp -64.66 -44.3 90.84 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.585 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 145' ' ' ALA . 79.9 mt -58.64 -50.29 79.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.544 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -65.48 -39.97 92.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.502 -179.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.8 m -57.4 -49.33 76.55 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.779 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.97 ' HB2' HD13 ' A' ' 163' ' ' LEU . 4.2 m-85 -72.3 -43.12 64.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.708 0.29 . . . . 0.0 111.355 -179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 69.9 m -54.38 139.13 37.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.106 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 5.3 m120 66.12 135.67 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.095 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 79.39 -35.99 2.0 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.895 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . 0.621 ' HB2' HH21 ' A' ' 160' ' ' ARG . 43.7 t 61.83 49.08 4.98 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.005 0.431 . . . . 0.0 110.793 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 62.3 m -57.72 -35.12 70.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.337 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.474 ' HG3' ' N ' ' A' ' 159' ' ' ASP . 53.9 tptt -130.48 170.35 14.34 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.669 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.474 ' N ' ' HG3' ' A' ' 158' ' ' LYS . 31.2 m-20 -54.25 136.98 42.27 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 121.09 0.471 . . . . 0.0 111.537 -179.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.621 HH21 ' HB2' ' A' ' 156' ' ' SER . 21.7 mmt85 -64.61 -32.78 74.58 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.487 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.429 ' HG2' ' HB3' ' A' ' 159' ' ' ASP . 8.5 ptpp? -53.06 -45.25 68.01 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.037 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.456 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 98.2 mt -62.91 -38.3 90.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.255 179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.97 HD13 ' HB2' ' A' ' 152' ' ' TYR . 54.5 tp -58.12 -43.4 87.18 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.393 179.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 90.5 mt -59.51 -42.49 92.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.529 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.7 m -59.06 -43.04 91.68 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.944 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.01 -44.16 97.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.186 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.489 HE21 ' HG ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -57.74 -43.23 85.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.4 -0.363 . . . . 0.0 110.398 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -60.51 -38.02 83.03 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.048 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.6 mtp -62.11 -47.22 85.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.848 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.515 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.4 tm? -57.8 -48.55 79.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.006 -179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -43.53 98.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.013 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.558 ' OD1' ' HE2' ' A' ' 176' ' ' LYS . 8.7 t70 -61.29 -43.58 98.65 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.092 -179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.545 ' O ' HG13 ' A' ' 177' ' ' ILE . 38.8 t -59.72 -46.17 89.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.921 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -57.93 -40.31 80.14 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.901 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 88.7 m -58.62 -45.93 88.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.907 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.558 ' HE2' ' OD1' ' A' ' 172' ' ' ASP . 68.0 mttm -61.07 -43.81 98.32 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.551 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 173' ' ' SER . 63.0 mt -55.61 -40.87 61.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.355 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -64.97 -48.62 73.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.073 -179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 43.4 mm -61.73 -47.19 94.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.057 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.715 HD13 ' HB3' ' A' ' 134' ' ' GLN . 74.8 mt -61.82 -40.58 87.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.001 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.406 HH11 ' HG3' ' A' ' 181' ' ' ARG . 41.5 ttt85 -55.18 -44.75 75.52 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.321 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 43.9 tpp -61.23 -39.98 92.32 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.154 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -59.66 -41.01 89.63 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.709 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.491 HD23 HD13 ' A' ' 131' ' ' LEU . 8.2 mt -59.31 -43.99 92.58 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.226 0.536 . . . . 0.0 109.954 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.621 ' HA ' HH11 ' A' ' 185' ' ' ARG . 3.3 mmm180 -56.6 -41.87 77.76 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.218 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -61.95 -39.39 91.94 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.716 179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.65 -44.96 95.81 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.018 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 86.1 mt -63.02 -41.72 99.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.731 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 85.0 mt-30 -64.51 -36.19 83.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.065 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.54 -52.82 59.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.554 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.3 t0 -72.25 -60.04 2.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.011 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -74.44 134.15 42.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.964 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 62.8 tp -172.48 128.28 0.54 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.918 0.389 . . . . 0.0 111.042 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 8.9 mp0 -72.88 -134.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.858 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.548 HD22 ' H ' ' A' ' 196' ' ' GLN . 0.8 OUTLIER -171.1 135.88 1.03 Allowed 'General case' 0 CA--C 1.528 0.115 0 CA-C-O 120.656 0.265 . . . . 0.0 110.416 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.548 ' H ' HD22 ' A' ' 195' ' ' ASN . 54.2 tt0 -138.76 135.16 34.4 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.024 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.1 138.2 58.48 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.24 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . -59.45 140.2 88.61 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.046 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 48.1 Cg_exo . . . . . 0 C--O 1.248 1.014 0 C-N-CA 122.577 2.185 . . . . 0.0 112.367 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.575 -0.21 . . . . 0.0 112.575 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.561 HD12 ' HD2' ' A' ' 121' ' ' PRO . 7.1 tp -171.89 125.52 0.55 Allowed Pre-proline 0 CA--C 1.532 0.285 0 CA-C-O 120.564 0.221 . . . . 0.0 110.923 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.561 ' HD2' HD12 ' A' ' 120' ' ' ILE . 2.9 Cg_exo -76.01 49.32 2.49 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.038 2.492 . . . . 0.0 112.742 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -163.39 -151.88 0.19 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.067 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 124' ' ' ASN . 74.6 p -84.88 -65.64 0.99 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.665 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 123' ' ' THR . 17.8 t-20 178.45 46.32 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 121.036 0.446 . . . . 0.0 110.35 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.675 HD12 ' N ' ' A' ' 126' ' ' SER . 4.0 pp -75.54 -26.23 57.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.393 -179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.675 ' N ' HD12 ' A' ' 125' ' ' LEU . 55.9 m -54.8 -49.53 70.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.827 -179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.551 ' HA ' ' HE ' ' A' ' 127' ' ' ARG . 4.0 mmp_? -62.33 -45.47 93.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.707 0.289 . . . . 0.0 111.537 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 59.8 t -58.64 -46.21 90.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.61 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.63 -45.72 92.99 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.702 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.746 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -65.62 -44.98 91.68 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 113.117 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 184' ' ' LEU . 92.4 mt -65.61 -43.22 90.3 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.744 -0.268 . . . . 0.0 111.474 -179.378 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 68.8 mm-40 -64.39 -46.61 82.58 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.746 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 66.0 pttt -57.83 -41.12 81.65 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.771 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 13.2 mm100 -59.46 -43.27 93.23 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.692 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.508 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.3 tm? -60.43 -43.82 96.41 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.88 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.45 -47.3 84.47 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.485 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 65.6 mt -57.1 -40.93 76.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.615 ' HB3' HD11 ' A' ' 177' ' ' ILE . 63.2 mm-40 -61.67 -42.1 98.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.0 mt -59.16 -42.83 91.67 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.292 -179.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.07 -47.75 83.29 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.732 -179.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 38.7 t -71.28 -48.77 52.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.469 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -60.88 -52.21 66.03 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.5 -179.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -59.21 -46.44 88.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.832 0.349 . . . . 0.0 110.752 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.628 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -62.34 -34.84 90.52 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.149 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.565 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.89 -40.3 91.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.937 0.399 . . . . 0.0 110.211 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -59.84 -42.08 92.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.32 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.628 HD22 ' HA2' ' A' ' 144' ' ' GLY . 76.7 m-20 -59.99 -42.12 93.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.201 179.246 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.518 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 89.1 mmm -64.46 -42.66 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.63 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.565 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.3 mt -60.69 -50.46 80.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.472 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 72.6 mt-30 -66.13 -42.52 89.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.761 -179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 96.2 m -60.42 -49.53 77.21 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.919 ' HB2' HD13 ' A' ' 163' ' ' LEU . 2.2 m-85 -73.54 -51.33 17.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.717 0.294 . . . . 0.0 111.706 -179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.5 t -64.93 134.55 54.21 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.981 0.419 . . . . 0.0 111.747 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.401 ' N ' HD22 ' A' ' 154' ' ' ASN . 2.9 m120 55.8 45.59 23.99 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.531 179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 169.42 132.03 1.39 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.87 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 52.8 m -62.25 142.22 57.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.529 0.204 . . . . 0.0 110.46 179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 86.7 m -155.54 -53.51 0.09 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.391 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.53 ' HG2' ' H ' ' A' ' 159' ' ' ASP . 20.8 ttmm -176.01 -132.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.59 -0.277 . . . . 0.0 110.858 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.53 ' H ' ' HG2' ' A' ' 158' ' ' LYS . 57.8 m-20 -71.23 137.71 48.87 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.011 0.434 . . . . 0.0 111.856 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.564 ' HE ' HD23 ' A' ' 163' ' ' LEU . 12.0 tpt180 -71.78 -37.09 70.49 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.543 179.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -53.31 -41.72 65.93 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.609 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.562 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 97.2 mt -58.4 -39.02 78.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.437 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.919 HD13 ' HB2' ' A' ' 152' ' ' TYR . 30.8 tp -57.78 -46.86 83.98 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.068 178.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 93.2 mt -58.77 -41.72 87.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.938 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 86.8 m -61.12 -41.32 96.49 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.519 179.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.5 -38.29 80.52 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.445 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -60.41 -45.47 93.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.133 179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -62.5 -40.78 97.8 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.538 179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.6 mmm -60.17 -49.12 78.87 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.241 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.585 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 2.9 tm? -61.48 -44.32 97.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.196 -179.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.3 -47.17 82.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.288 -179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.421 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 63.6 t0 -66.38 -40.95 90.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.191 -179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.543 ' O ' HG13 ' A' ' 177' ' ' ILE . 50.5 m -62.12 -52.41 63.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.914 -179.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.597 ' NZ ' ' HB2' ' A' ' 174' ' ' LYS . 0.0 OUTLIER -61.83 -41.65 98.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.506 -179.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 93.4 m -57.84 -48.53 79.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.795 0.331 . . . . 0.0 111.255 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.559 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 4.0 mmmp? -58.98 -40.25 84.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.93 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.615 HD11 ' HB3' ' A' ' 138' ' ' GLU . 40.0 mt -59.91 -38.63 77.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . 0.402 ' O ' ' HB3' ' A' ' 181' ' ' ARG . 58.2 m-20 -60.86 -45.04 96.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.022 0.439 . . . . 0.0 110.009 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 56.9 mt -59.59 -49.05 85.12 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.361 179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.525 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.5 mt -62.18 -36.42 74.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.606 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 185' ' ' ARG . 51.2 ttt-85 -52.39 -50.29 62.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.543 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 62.0 mtm -63.54 -38.75 92.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.871 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 24.5 mt-30 -56.72 -46.42 81.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.747 179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.566 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -61.92 -42.12 98.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.002 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 3.7 mmp_? -52.42 -48.27 65.85 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.042 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -65.21 -35.32 80.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.459 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -58.44 -44.11 89.06 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.789 0.328 . . . . 0.0 111.171 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.437 HD13 ' O ' ' A' ' 184' ' ' LEU . 9.9 mp -67.58 -41.88 83.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.193 179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 94.8 mm-40 -56.58 -45.54 81.28 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.802 0.334 . . . . 0.0 111.021 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -71.89 -36.9 70.17 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.285 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -57.27 -49.79 74.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.669 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.575 HE21 ' HA ' ' A' ' 189' ' ' GLN . 25.8 pt20 -65.36 127.54 32.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.825 0.345 . . . . 0.0 111.047 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 41.6 tp 179.56 59.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.515 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -161.75 -37.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.404 -179.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.9 p-10 -53.9 -47.45 71.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.984 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -72.02 129.95 39.77 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.807 179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -69.99 134.07 47.93 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.045 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.571 ' N ' ' HD2' ' A' ' 199' ' ' PRO . . . -63.9 -50.44 70.18 Favored Pre-proline 0 CA--C 1.533 0.297 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.633 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.571 ' HD2' ' N ' ' A' ' 198' ' ' ALA . 35.8 Cg_endo . . . . . 0 C--O 1.249 1.055 0 C-N-CA 122.136 1.89 . . . . 0.0 112.333 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.198 0 N-CA-C 112.576 -0.209 . . . . 0.0 112.576 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.665 HD12 ' HD2' ' A' ' 121' ' ' PRO . 7.8 tp -176.29 128.05 0.35 Allowed Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 120.551 0.215 . . . . 0.0 110.901 -179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.665 ' HD2' HD12 ' A' ' 120' ' ' ILE . 40.7 Cg_exo -57.47 -49.24 14.18 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.391 2.061 . . . . 0.0 112.409 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.15 -95.43 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.293 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 8.9 t 42.46 48.78 4.59 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.159 0.504 . . . . 0.0 111.661 -179.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 13.8 p-10 -165.05 -37.58 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.567 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 99.2 mt -57.01 -38.69 73.45 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.075 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.2 t -56.0 -45.67 78.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.773 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.408 ' HG2' HH11 ' A' ' 127' ' ' ARG . 54.2 ttp85 -64.96 -42.77 94.32 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.759 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 60.4 t -58.25 -48.25 85.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.579 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -61.5 -45.64 93.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.701 -179.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.588 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -57.98 -48.73 80.69 Favored Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.989 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.749 HD13 HD22 ' A' ' 184' ' ' LEU . 64.4 mt -68.34 -43.43 77.5 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.015 0.436 . . . . 0.0 111.05 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.1 tp10 -61.75 -46.53 89.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 129' ' ' ALA . 16.9 ptpt -61.71 -40.37 94.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.978 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -56.21 -45.83 79.72 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.8 0.333 . . . . 0.0 110.761 179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.478 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 97.2 mt -58.91 -45.93 89.14 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.315 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -63.4 -47.76 80.65 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.824 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 133' ' ' LYS . 76.4 mt -56.56 -43.34 78.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.437 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.563 ' HG2' ' O ' ' A' ' 134' ' ' GLN . 4.0 mm-40 -61.87 -41.79 98.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.158 -179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.478 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.2 mt -57.91 -39.95 79.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.859 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -62.69 -48.99 76.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.035 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 51.1 t -65.5 -42.49 93.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.11 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -59.69 -46.41 89.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.669 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -61.72 -47.23 86.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.525 179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.538 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -59.97 -36.41 90.16 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.014 -0.612 . . . . 0.0 112.606 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.632 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -66.57 -41.52 88.46 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.99 0.424 . . . . 0.0 110.501 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 58.2 mm-40 -62.78 -41.51 99.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.675 179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.538 HD22 ' HA2' ' A' ' 144' ' ' GLY . 78.7 m-20 -60.24 -39.7 87.64 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.654 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.483 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 85.0 mtp -70.57 -48.93 52.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.222 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.498 HG13 ' O ' ' A' ' 145' ' ' ALA . 77.2 mt -53.83 -47.29 63.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.361 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -66.69 -38.17 86.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.316 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.615 ' O ' HG21 ' A' ' 157' ' ' THR . 55.6 m -61.56 -51.37 68.84 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.654 ' HB2' HD13 ' A' ' 163' ' ' LEU . 18.4 m-85 -74.82 -51.25 14.5 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.811 0.301 . . . . 0.0 111.811 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . 0.407 ' O ' ' HB3' ' A' ' 154' ' ' ASN . 47.4 t -68.43 115.32 7.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.79 0.329 . . . . 0.0 111.622 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 153' ' ' SER . 24.1 p30 172.55 -35.22 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.516 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -167.48 -48.27 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.755 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 48.1 t -174.97 -50.44 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.76 0.28 . . . . 0.0 111.412 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.615 HG21 ' O ' ' A' ' 151' ' ' THR . 71.4 p 49.02 -145.77 0.38 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.9 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.66 ' HG3' ' H ' ' A' ' 159' ' ' ASP . 19.2 tptm -72.17 -143.25 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.66 ' H ' ' HG3' ' A' ' 158' ' ' LYS . 1.5 m-20 -72.78 127.55 32.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.519 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 34.0 ttm180 -72.17 -15.65 61.97 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.1 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.583 ' HG2' ' HB3' ' A' ' 159' ' ' ASP . 14.6 ptmm? -53.37 -40.86 65.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.01 0.433 . . . . 0.0 110.11 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 92.4 mt -68.11 -31.56 71.24 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.365 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.654 HD13 ' HB2' ' A' ' 152' ' ' TYR . 51.2 tp -57.91 -48.78 78.86 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.635 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 83.9 mt -63.92 -44.84 91.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.821 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.1 m -60.96 -41.21 95.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.03 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.59 -45.01 95.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.902 179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.552 HE21 ' HG ' ' A' ' 163' ' ' LEU . 73.3 mt-30 -59.45 -40.04 85.54 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.101 179.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.622 ' HA ' HE21 ' A' ' 171' ' ' GLN . 53.3 tt0 -61.03 -39.39 89.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.357 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 67.2 mtp -66.16 -45.63 80.25 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.086 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.632 HD23 ' HB3' ' A' ' 145' ' ' ALA . 2.9 tm? -57.38 -52.18 66.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.256 -179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.622 HE21 ' HA ' ' A' ' 168' ' ' GLN . 25.6 pt20 -64.18 -40.94 97.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.375 -179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -61.79 -44.13 97.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.898 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 177' ' ' ILE . 47.6 t -59.11 -45.57 90.55 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.046 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -58.69 -41.98 87.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.907 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.0 m -56.24 -47.13 79.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.969 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.524 ' O ' HG13 ' A' ' 180' ' ' ILE . 63.7 mttp -61.43 -39.8 92.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.078 179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.576 ' O ' ' HG2' ' A' ' 181' ' ' ARG . 57.7 mt -62.72 -41.58 92.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.415 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -60.57 -51.44 69.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.368 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.445 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 34.1 pt -63.07 -40.02 87.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.512 -179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.56 HD13 ' HB3' ' A' ' 134' ' ' GLN . 62.4 mt -60.22 -45.34 96.22 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-O 120.59 0.233 . . . . 0.0 110.824 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' ' 177' ' ' ILE . 26.1 mmm180 -56.2 -44.13 79.17 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.324 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.762 ' HG3' HH21 ' A' ' 185' ' ' ARG . 45.8 ttm -59.36 -40.23 85.79 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.412 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 99.3 mm-40 -60.75 -38.28 84.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.269 179.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.749 HD22 HD13 ' A' ' 131' ' ' LEU . 8.3 mt -60.34 -43.67 96.22 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.227 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.762 HH21 ' HG3' ' A' ' 182' ' ' MET . 72.6 mtm180 -56.8 -46.3 81.66 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.176 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -65.29 -38.87 91.56 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.391 179.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -59.25 -39.59 83.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.949 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 25.5 tp -67.76 -40.62 84.06 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.126 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' ' 193' ' ' LEU . 98.2 mm-40 -57.77 -45.06 86.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.129 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.66 -40.67 92.67 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.336 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -62.26 -50.3 72.27 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.394 -179.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -62.27 -34.39 76.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.18 -179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 189' ' ' GLN . 95.2 mt -76.94 46.46 0.47 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.185 179.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 194' ' ' GLU . 37.8 tt0 -172.65 42.79 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.184 0.516 . . . . 0.0 110.089 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -63.37 144.03 57.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.021 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -55.76 138.58 47.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.807 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -55.81 134.34 51.69 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.166 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.509 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -171.03 57.27 0.26 Allowed Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.092 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.509 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 39.6 Cg_exo . . . . . 0 C--O 1.249 1.065 0 C-N-CA 122.479 2.119 . . . . 0.0 112.28 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.713 HD12 HG22 ' A' ' 128' ' ' VAL . 68.7 mt -60.16 131.74 89.87 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.562 0.22 . . . . 0.0 110.962 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.61 -40.95 60.71 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.595 2.197 . . . . 0.0 112.413 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.454 ' O ' ' HB ' ' A' ' 123' ' ' THR . . . -169.56 -110.5 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.006 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.454 ' HB ' ' O ' ' A' ' 122' ' ' ALA . 85.0 m 75.89 -40.39 0.4 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.24 0.337 . . . . 0.0 111.764 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.471 ' OD1' ' HB3' ' A' ' 126' ' ' SER . 25.8 t-20 -169.31 -41.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 121.312 -0.155 . . . . 0.0 111.234 -179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 124' ' ' ASN . 93.8 mt 75.11 -50.65 0.66 Allowed 'General case' 0 N--CA 1.467 0.424 0 O-C-N 123.595 0.559 . . . . 0.0 111.513 -179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.471 ' HB3' ' OD1' ' A' ' 124' ' ' ASN . 47.3 t -60.07 -38.88 84.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.853 0.359 . . . . 0.0 110.56 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.506 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 29.7 tpt180 -60.76 -42.61 97.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.639 179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.713 HG22 HD12 ' A' ' 120' ' ' ILE . 92.1 t -57.46 -53.3 45.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.347 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -63.83 -36.74 84.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -59.89 -43.8 97.71 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.847 -0.692 . . . . 0.0 112.341 179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.535 ' HB3' HD11 ' A' ' 184' ' ' LEU . 77.5 mt -67.1 -41.6 86.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.89 0.376 . . . . 0.0 110.807 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.0 mm-40 -63.18 -49.63 73.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.591 -179.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.441 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.36 -41.49 89.38 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.585 0.231 . . . . 0.0 110.922 -179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.1 mm-40 -58.61 -41.32 85.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.937 0.399 . . . . 0.0 110.835 179.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 135' ' ' LEU . 1.7 tm? -59.95 -43.97 94.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.641 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -67.66 -46.84 71.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.968 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 133' ' ' LYS . 70.9 mt -58.5 -46.54 89.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.542 -179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.465 ' CD ' ' HB3' ' A' ' 176' ' ' LYS . 96.0 mt-10 -59.62 -45.32 92.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.486 -0.325 . . . . 0.0 110.79 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.596 ' HB3' HE21 ' A' ' 143' ' ' GLN . 70.6 mt -62.16 -33.57 74.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.341 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -58.67 -48.46 81.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.702 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.4 t -71.4 -42.21 73.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.17 179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.665 ' HZ3' ' HD3' ' A' ' 174' ' ' LYS . 39.5 ttmt -58.67 -50.15 74.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.596 HE21 ' HB3' ' A' ' 139' ' ' LEU . 74.7 mt-30 -62.34 -42.98 99.83 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.649 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.534 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.24 -38.01 93.87 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.104 179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.21 -40.94 86.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.97 0.414 . . . . 0.0 110.375 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 95.9 mt-10 -59.09 -44.6 91.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.268 179.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -39.84 91.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.798 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.534 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 87.0 mtp -64.57 -37.21 86.76 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.693 179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 72.4 mt -64.62 -45.84 94.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.817 0.342 . . . . 0.0 111.042 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -69.61 -42.28 74.58 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.352 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.403 ' C ' ' H ' ' A' ' 153' ' ' SER . 88.8 m -68.13 -48.54 65.14 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.656 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.655 ' HA ' ' HB ' ' A' ' 157' ' ' THR . 1.3 m-85 -75.31 21.4 0.13 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.67 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . 0.403 ' H ' ' C ' ' A' ' 151' ' ' THR . 65.1 m -75.95 -44.33 40.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.882 0.372 . . . . 0.0 110.715 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -172.46 -44.43 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.765 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -63.22 132.24 42.31 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.264 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.5 t 65.93 -74.64 0.06 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 122.407 0.283 . . . . 0.0 111.126 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.655 ' HB ' ' HA ' ' A' ' 152' ' ' TYR . 90.6 m -64.0 146.47 54.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.783 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -131.5 -37.91 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.425 -179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 24.8 m-20 -57.77 123.78 16.89 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.441 -179.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 48.3 mmt-85 -74.09 -38.36 63.89 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.153 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -53.21 -44.48 68.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.144 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.448 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 91.8 mt -61.35 -39.89 92.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.556 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 152' ' ' TYR . 65.5 tp -58.66 -45.59 89.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.649 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.441 HD23 ' NE2' ' A' ' 167' ' ' GLN . 91.1 mt -59.45 -40.65 87.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.57 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -57.57 -42.95 84.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.753 179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -60.43 -41.96 95.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.676 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.441 ' NE2' HD23 ' A' ' 164' ' ' LEU . 73.1 mt-30 -57.54 -43.06 84.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.319 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.783 ' HA ' HE21 ' A' ' 171' ' ' GLN . 41.1 tt0 -60.34 -40.57 91.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.126 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.523 ' HA ' ' OD2' ' A' ' 172' ' ' ASP . 0.0 OUTLIER -60.74 -36.61 79.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.847 179.52 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.536 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.8 tm? -69.2 -45.81 68.99 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.707 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.783 HE21 ' HA ' ' A' ' 168' ' ' GLN . 24.6 pt20 -64.76 -45.96 84.15 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.523 ' OD2' ' HA ' ' A' ' 169' ' ' MET . 3.0 p30 -64.42 -37.73 88.55 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 121.039 -0.264 . . . . 0.0 111.07 -179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.407 ' HB2' ' HB2' ' A' ' 142' ' ' LYS . 90.3 p -62.76 -44.04 97.22 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.724 0.297 . . . . 0.0 110.438 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.665 ' HD3' ' HZ3' ' A' ' 142' ' ' LYS . 74.9 mmtt -54.84 -48.15 73.23 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.307 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.1 m -56.06 -43.44 77.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.959 179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.465 ' HB3' ' CD ' ' A' ' 138' ' ' GLU . 63.3 mttp -53.37 -46.89 69.79 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.052 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.521 HD13 ' HZ1' ' A' ' 142' ' ' LYS . 1.8 mp -58.16 -41.74 81.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.691 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . 0.415 ' HA ' ' HD2' ' A' ' 181' ' ' ARG . 1.2 m-20 -55.76 -44.37 77.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.194 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.475 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 1.7 mp -59.36 -46.34 92.63 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.163 179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.683 ' O ' HD13 ' A' ' 184' ' ' LEU . 44.6 mt -57.81 -41.11 79.01 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.728 0.299 . . . . 0.0 110.889 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 98.4 mtt180 -55.04 -50.32 69.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.225 0.536 . . . . 0.0 110.82 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 25.1 ttm -67.49 -42.99 82.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.318 -0.856 . . . . 0.0 112.093 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.475 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 3.3 mm100 -62.16 -47.8 82.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.82 0.343 . . . . 0.0 111.474 -179.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.683 HD13 ' O ' ' A' ' 180' ' ' ILE . 6.5 mp -61.69 -47.86 83.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.51 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.519 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 44.8 mmm-85 -60.25 -46.4 89.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.72 0.295 . . . . 0.0 110.963 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -61.01 -39.83 91.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.038 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.47 -43.99 96.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.075 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 84.5 mt -65.82 -42.73 90.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.026 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 99.3 mm-40 -61.65 -43.09 99.51 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.053 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -59.92 -45.89 91.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.108 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 63.8 t0 -63.24 -42.85 99.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.729 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.44 ' O ' ' HG3' ' A' ' 192' ' ' GLN . 3.1 tp-100 -79.21 45.56 0.65 Allowed 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.768 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 36.7 tp -175.58 52.67 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.355 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -165.74 144.51 6.1 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.076 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -165.02 -38.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -58.47 134.5 56.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.743 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.45 133.18 55.85 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.281 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -174.47 133.41 0.53 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.83 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo . . . . . 0 C--O 1.249 1.052 0 C-N-CA 122.457 2.105 . . . . 0.0 112.226 179.935 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.195 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.535 ' N ' HD12 ' A' ' 120' ' ' ILE . 2.3 mp -64.18 131.1 94.9 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 120.575 0.226 . . . . 0.0 110.827 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 3.2 Cg_exo -76.25 38.5 0.61 Allowed 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.891 2.394 . . . . 0.0 112.497 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 55.87 50.79 13.32 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.787 0.327 . . . . 0.0 111.162 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.432 HG22 ' HD2' ' A' ' 121' ' ' PRO . 9.2 t -136.45 37.93 2.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.063 0.459 . . . . 0.0 111.128 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.556 ' O ' HG23 ' A' ' 128' ' ' VAL . 75.5 m-20 -157.78 -47.55 0.06 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.439 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.519 ' O ' HD13 ' A' ' 125' ' ' LEU . 3.1 tm? -62.14 -44.46 96.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.442 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.2 m -60.02 -44.47 94.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.056 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -60.41 -45.0 95.18 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.08 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 124' ' ' ASN . 57.3 t -61.84 -44.4 98.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.237 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -58.58 -43.82 89.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.12 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -63.24 -43.13 98.98 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.518 179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 184' ' ' LEU . 92.3 mt -67.52 -40.27 85.1 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.723 0.297 . . . . 0.0 111.196 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 5.2 mm-40 -64.44 -49.14 72.64 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.586 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.581 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -58.11 -41.38 83.43 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.876 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.541 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 12.9 mm100 -61.03 -42.12 97.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.88 0.372 . . . . 0.0 110.76 179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.503 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 67.0 tp -59.64 -45.51 91.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.102 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -62.68 -40.88 98.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.55 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.648 HG23 ' NZ ' ' A' ' 140' ' ' LYS . 81.8 mt -61.33 -50.14 81.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.876 -179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.652 ' OE1' HD12 ' A' ' 180' ' ' ILE . 24.8 pt-20 -65.86 -39.97 91.23 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.278 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.8 mt -58.87 -44.91 91.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 112.046 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.648 ' NZ ' HG23 ' A' ' 137' ' ' ILE . 23.5 pttm -65.68 -42.95 90.65 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.868 -179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.5 t -64.07 -43.51 97.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.967 0.413 . . . . 0.0 110.627 179.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.451 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttm -63.08 -43.27 99.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.626 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.65 -43.02 98.08 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.834 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.452 ' O ' ' HG2' ' A' ' 148' ' ' MET . . . -61.32 -38.95 96.54 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.698 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.452 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -69.01 -42.18 76.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.011 0.434 . . . . 0.0 110.95 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 55.5 mt-10 -61.72 -44.72 96.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.071 -179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 22.4 t-20 -60.25 -44.18 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.086 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.452 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.8 mmm -64.06 -48.78 74.92 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.348 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.612 HD11 ' HA ' ' A' ' 167' ' ' GLN . 77.6 mt -59.69 -46.46 93.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.422 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -65.67 -41.14 92.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.443 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.6 m -58.31 -45.66 87.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.859 0.361 . . . . 0.0 110.919 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.556 ' HA ' ' HB ' ' A' ' 157' ' ' THR . 2.3 m-30 -66.22 -47.78 72.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.718 179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 95.5 p -71.09 128.53 36.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.333 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 2.8 m120 52.93 57.57 6.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.397 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -159.13 -143.45 3.67 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.808 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 78.8 p -110.66 49.48 0.86 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.832 0.348 . . . . 0.0 111.307 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.556 ' HB ' ' HA ' ' A' ' 152' ' ' TYR . 89.7 m -161.29 131.89 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.797 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.552 ' HD2' ' N ' ' A' ' 158' ' ' LYS . 0.0 OUTLIER -129.27 29.6 5.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.907 -179.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -73.51 93.82 2.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.496 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.419 ' HG3' HH11 ' A' ' 160' ' ' ARG . 42.7 mmm-85 -65.55 -39.82 92.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.474 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 62.4 tttp -56.3 -56.63 18.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.952 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.9 mp -68.78 -32.42 72.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.951 179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 167' ' ' GLN . 45.5 tp -54.86 -50.6 68.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.843 0.354 . . . . 0.0 110.236 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' A' ' 168' ' ' GLN . 81.3 mt -64.35 -37.98 89.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.874 179.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 96.9 m -56.58 -48.43 77.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.106 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.37 -42.26 88.27 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.874 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.612 ' HA ' HD11 ' A' ' 149' ' ' ILE . 25.0 mt-30 -56.79 -42.76 80.04 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.446 179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 164' ' ' LEU . 27.9 mt-30 -61.34 -41.59 97.29 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.228 179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.0 mtp -58.63 -47.34 84.74 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.494 179.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 174' ' ' LYS . 57.0 tp -58.63 -40.67 83.99 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.887 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 -57.82 -48.0 81.02 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.903 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.47 -42.92 97.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.412 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . . . . . . . . . 49.8 m -59.04 -45.91 89.56 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.755 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 170' ' ' LEU . 14.5 mmmm -54.67 -42.05 70.89 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.493 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.0 m -58.76 -40.97 85.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.515 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.414 ' O ' HG13 ' A' ' 180' ' ' ILE . 54.5 mtpt -58.62 -46.69 86.52 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.221 179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.525 ' O ' ' HG3' ' A' ' 181' ' ' ARG . 2.0 mp -58.82 -42.49 85.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.311 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 182' ' ' MET . 27.4 m-20 -57.56 -54.89 41.77 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.737 0.303 . . . . 0.0 111.754 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.429 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.38 -46.55 96.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.602 -179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.652 HD12 ' OE1' ' A' ' 138' ' ' GLU . 53.9 mt -57.65 -44.46 85.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.023 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.525 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 78.1 mtp180 -56.16 -39.35 72.19 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.2 mmt -59.13 -41.19 87.66 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.597 179.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.72 -44.68 77.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.274 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.63 HD13 HD13 ' A' ' 131' ' ' LEU . 4.4 mm? -61.21 -49.64 76.33 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.633 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.556 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 3.5 ptm85 -59.51 -44.42 93.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.137 -179.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.683 ' HD3' ' NE2' ' A' ' 189' ' ' GLN . 21.2 mmt85 -62.83 -38.56 91.22 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.868 0.366 . . . . 0.0 110.961 179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -68.7 -40.69 79.88 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.593 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 91.8 mt -66.03 -46.4 78.01 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.066 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.683 ' NE2' ' HD3' ' A' ' 186' ' ' ARG . 16.4 pt20 -62.58 -49.17 76.31 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -179.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.76 -52.51 29.72 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.9 t0 -67.71 -59.77 3.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.725 0.298 . . . . 0.0 110.979 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.438 ' HB3' ' O ' ' A' ' 188' ' ' LEU . 8.1 tt0 -84.12 133.96 34.61 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.031 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 36.7 mt -156.22 37.0 0.34 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.789 179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 51.38 -143.22 0.66 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.07 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.49 ' OD1' ' HG3' ' A' ' 196' ' ' GLN . 20.1 p30 -174.87 -39.83 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.584 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.49 ' HG3' ' OD1' ' A' ' 195' ' ' ASN . 86.5 mt-30 -68.49 137.21 54.23 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.773 179.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.73 134.97 57.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.999 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 65.41 133.25 0.04 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.415 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--O 1.249 1.03 0 C-N-CA 122.583 2.189 . . . . 0.0 112.373 179.914 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.133 0 N-CA-C 112.5 -0.24 . . . . 0.0 112.5 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 75.3 mt 65.05 128.2 0.03 OUTLIER Pre-proline 0 CA--C 1.53 0.203 0 CA-C-O 120.821 0.343 . . . . 0.0 111.331 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.61 138.63 35.54 Favored 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.559 2.173 . . . . 0.0 112.627 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 69.91 -65.84 0.3 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.015 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 86.4 m -61.13 125.62 24.38 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.679 0.276 . . . . 0.0 110.83 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.418 ' O ' HG23 ' A' ' 128' ' ' VAL . 44.3 t30 -179.12 -36.7 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.908 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 91.9 mt -54.15 -42.25 69.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 55.8 m -58.68 -44.99 90.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.902 179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.474 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 79.4 ttt180 -64.08 -39.94 95.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.782 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 124' ' ' ASN . 79.2 t -58.94 -51.29 74.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.59 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.77 -39.44 93.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.294 -179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.605 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -59.2 -44.69 96.24 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.58 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 87.6 mt -65.39 -44.33 87.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.853 0.358 . . . . 0.0 111.143 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -62.73 -46.39 88.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.734 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 24.2 pttm -58.98 -38.48 79.23 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.662 0.268 . . . . 0.0 110.778 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.561 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 3.3 mm100 -59.71 -46.49 88.93 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.787 179.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 62.2 tp -56.98 -44.85 83.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.568 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.86 -51.06 71.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.773 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.518 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.8 mt -60.97 -46.3 96.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.189 -179.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.647 ' HB3' HG12 ' A' ' 177' ' ' ILE . 0.2 OUTLIER -57.39 -46.27 83.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.951 -179.779 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 94.2 mt -58.1 -42.66 86.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.662 0.268 . . . . 0.0 111.053 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.482 ' HD3' ' C ' ' A' ' 140' ' ' LYS . 7.4 tmtm? -62.13 -45.88 91.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.492 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 137' ' ' ILE . 47.8 t -62.49 -44.49 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.205 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -59.89 -45.23 93.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.942 -179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -62.04 -39.54 92.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.695 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.3 -40.99 96.65 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.51 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.491 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.15 -42.77 83.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.981 0.419 . . . . 0.0 110.412 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.47 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 51.0 mt-10 -61.96 -40.4 95.45 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.673 179.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.454 ' HA ' ' NE2' ' A' ' 150' ' ' GLN . 0.8 OUTLIER -58.68 -44.83 90.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.546 179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.432 ' HB2' ' HE3' ' A' ' 148' ' ' MET . 69.5 mtm -66.35 -41.09 90.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.151 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.491 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.4 mt -62.8 -49.5 83.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.799 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 16.2 pt20 -64.13 -40.74 96.82 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.769 0.319 . . . . 0.0 111.663 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.2 m -65.68 -42.91 90.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.472 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . . . . . . . . . 2.7 m-30 -74.72 21.91 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.1 -179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 73.8 m -75.67 -47.05 27.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.755 0.312 . . . . 0.0 110.584 179.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -174.13 125.92 0.35 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.878 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 152.62 -141.2 8.24 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.174 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 58.0 m -68.23 -51.8 41.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.984 0.421 . . . . 0.0 110.146 179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 75.7 p -77.86 134.84 37.88 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.708 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.446 ' O ' ' HG2' ' A' ' 158' ' ' LYS . 59.8 tttp -169.77 39.86 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.071 0.462 . . . . 0.0 111.047 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -71.56 121.29 18.46 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.054 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 22.3 tpp180 -72.48 -46.92 52.53 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.413 -179.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -58.26 -49.74 76.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.89 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 59.9 tp -67.91 -33.48 74.78 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.868 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 69.1 tp -56.15 -47.46 78.17 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.423 179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 86.1 mt -65.0 -42.52 94.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.568 179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.0 m -59.24 -41.57 89.05 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.954 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.54 -44.17 97.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.882 179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.451 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 85.6 mt-30 -58.79 -41.71 87.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.895 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.35 -40.27 90.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.036 179.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 71.8 mtp -61.82 -48.54 80.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.787 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.525 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -57.97 -45.79 86.18 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.811 -179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 98.7 mm-40 -60.94 -41.0 95.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.164 -179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.3 t0 -65.56 -44.57 86.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.115 -179.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.541 ' HA ' ' HG2' ' A' ' 176' ' ' LYS . 52.8 m -66.65 -47.2 73.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.858 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.639 ' HD3' ' N ' ' A' ' 175' ' ' THR . 0.0 OUTLIER -60.25 -35.64 75.95 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.888 -0.325 . . . . 0.0 110.826 -179.679 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . 0.639 ' N ' ' HD3' ' A' ' 174' ' ' LYS . 85.7 m -71.47 -45.55 62.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.404 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 173' ' ' SER . 19.3 ptpt -63.81 -38.49 91.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.803 -179.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.647 HG12 ' HB3' ' A' ' 138' ' ' GLU . 85.3 mt -63.37 -43.99 98.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.951 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 40.5 m-20 -57.15 -44.04 83.08 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.966 0.413 . . . . 0.0 110.212 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 175' ' ' THR . 47.6 mm -61.2 -43.79 97.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.497 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 72.2 mt -58.82 -48.9 84.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.642 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 56.4 ttp180 -51.03 -41.65 59.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.252 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 48.4 tpp -60.71 -38.76 86.14 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.221 179.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.418 HE21 HD22 ' A' ' 131' ' ' LEU . 22.4 mt-30 -64.02 -43.72 94.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.967 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.471 ' O ' HD13 ' A' ' 188' ' ' LEU . 4.2 mm? -60.64 -54.57 43.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.497 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.487 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 16.3 ptm180 -60.08 -41.05 91.63 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.847 0.356 . . . . 0.0 110.682 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.24 -36.28 83.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.214 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -63.43 -47.13 83.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.389 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.471 HD13 ' O ' ' A' ' 184' ' ' LEU . 9.8 mp -66.06 -44.09 85.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.492 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 98.9 mm-40 -62.25 -43.05 99.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.297 -179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.06 -51.22 68.84 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.732 -179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 36.0 m-20 -64.04 -45.49 88.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.222 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -79.13 50.22 1.03 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.416 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.486 HD13 ' N ' ' A' ' 194' ' ' GLU . 2.2 tm? -167.01 123.81 1.2 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.814 0.34 . . . . 0.0 110.219 179.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.486 ' N ' HD13 ' A' ' 193' ' ' LEU . 55.2 mp0 -81.59 134.64 35.52 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.214 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 49.7 t30 -58.23 -35.24 71.4 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.033 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.417 ' O ' ' HD3' ' A' ' 199' ' ' PRO . 4.4 tp-100 -137.16 135.19 37.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.772 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.0 135.82 57.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.198 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 57.96 56.59 6.89 Favored Pre-proline 0 CA--C 1.53 0.188 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.512 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.417 ' HD3' ' O ' ' A' ' 196' ' ' GLN . 37.5 Cg_endo . . . . . 0 C--O 1.249 1.026 0 C-N-CA 122.388 2.058 . . . . 0.0 112.198 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 112.53 -0.228 . . . . 0.0 112.53 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.665 HG22 ' H ' ' A' ' 122' ' ' ALA . 69.4 mt -66.26 131.9 94.38 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-O 120.522 0.201 . . . . 0.0 111.197 179.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_exo -56.54 -31.93 88.1 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.534 2.156 . . . . 0.0 111.963 179.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.665 ' H ' HG22 ' A' ' 120' ' ' ILE . . . 64.7 34.47 9.62 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.371 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 68.6 m -91.97 84.84 5.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.565 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -166.17 -36.9 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.091 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.777 HD12 ' N ' ' A' ' 126' ' ' SER . 3.8 pp -55.82 -32.99 64.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.446 -179.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.777 ' N ' HD12 ' A' ' 125' ' ' LEU . 80.3 p -68.34 -48.16 65.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.294 -179.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.43 HH11 ' HG3' ' A' ' 127' ' ' ARG . 46.2 ttm-85 -65.38 -45.45 84.01 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.446 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 1.4 p -60.75 -44.55 97.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 121.255 0.55 . . . . 0.0 110.9 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.455 ' N ' ' CG1' ' A' ' 128' ' ' VAL . . . -58.44 -44.21 89.08 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.219 -0.901 . . . . 0.0 111.457 -179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.467 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.29 -44.2 98.01 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.785 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.56 HD13 ' HG ' ' A' ' 184' ' ' LEU . 92.6 mt -66.88 -42.42 85.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.689 0.28 . . . . 0.0 111.412 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 51.0 mt-10 -64.07 -47.92 78.24 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.865 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.4 ' O ' HG13 ' A' ' 137' ' ' ILE . 21.8 ptmt -59.07 -42.64 90.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.645 0.26 . . . . 0.0 111.154 -179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.562 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.6 mm100 -61.72 -39.84 92.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.92 0.391 . . . . 0.0 110.697 179.521 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.565 HD13 ' O ' ' A' ' 135' ' ' LEU . 2.8 tm? -58.76 -40.31 83.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.426 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' ' 140' ' ' LYS . . . -66.91 -43.34 83.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.385 179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.4 HG13 ' O ' ' A' ' 133' ' ' LYS . 64.8 mt -59.99 -49.66 83.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.06 -179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 135' ' ' LEU . 11.0 pt-20 -58.12 -43.28 87.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.065 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 77.3 mt -60.1 -42.24 94.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.665 0.269 . . . . 0.0 111.33 179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.6 ' HG2' ' O ' ' A' ' 136' ' ' ALA . 14.6 mmmm -60.11 -47.31 86.43 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.711 -179.355 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 48.4 t -64.56 -42.14 94.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.276 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.03 -50.96 71.68 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.269 -179.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -64.61 -49.18 72.1 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.246 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -55.51 -36.27 63.66 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.764 -0.731 . . . . 0.0 111.974 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.478 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.2 -40.74 94.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 110.131 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.0 mt-10 -62.07 -44.51 96.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.552 179.679 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -60.2 -40.11 88.92 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.742 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.46 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.3 mtp -65.3 -44.58 87.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.825 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.2 mt -61.94 -44.2 98.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.354 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 97.4 mm-40 -67.09 -45.48 77.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.443 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.2 m -61.92 -50.34 72.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.644 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.431 ' HA ' ' O ' ' A' ' 157' ' ' THR . 2.3 m-85 -63.47 -41.66 98.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.644 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 23.9 t -64.33 117.63 7.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.854 0.359 . . . . 0.0 111.113 -179.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 2.9 m120 59.66 113.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.765 -0.652 . . . . 0.0 112.182 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 59.74 156.67 0.03 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 121.175 -0.536 . . . . 0.0 113.835 178.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 58.5 m 59.62 63.91 1.42 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.582 0.23 . . . . 0.0 111.419 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 152' ' ' TYR . 85.6 m 66.22 143.33 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.811 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -161.98 44.45 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.875 0.369 . . . . 0.0 111.478 -179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -64.64 129.1 38.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.349 179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -67.05 -44.14 80.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.364 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -58.4 -48.93 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.797 0.332 . . . . 0.0 110.764 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 87.3 mt -65.96 -38.13 87.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.696 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 63.1 tp -56.94 -47.71 80.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.149 179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 89.5 mt -63.06 -41.2 99.4 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.994 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.0 m -60.18 -47.04 87.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.409 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -61.77 -49.62 75.63 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.216 -179.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -57.34 -37.23 72.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.984 0.421 . . . . 0.0 109.91 179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -60.46 -40.91 92.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.042 179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.422 ' HG3' ' O ' ' A' ' 165' ' ' THR . 40.9 mtm -61.78 -40.68 96.04 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.195 179.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.502 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 59.8 tp -61.36 -42.17 98.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.969 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.782 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 41.2 tt0 -57.86 -49.58 76.2 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.901 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 176' ' ' LYS . 33.3 m-20 -63.0 -40.85 99.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.769 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.492 ' O ' HG13 ' A' ' 177' ' ' ILE . 45.7 t -57.88 -44.77 86.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.782 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 53.8 mtmt -58.3 -51.62 69.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.936 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 84.8 m -55.63 -41.8 74.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.955 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 172' ' ' ASP . 75.7 mmtt -60.88 -43.65 98.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.764 179.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.516 HG12 ' CD ' ' A' ' 138' ' ' GLU . 49.3 mt -60.93 -44.92 98.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.698 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.93 -47.37 80.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.67 0.271 . . . . 0.0 111.587 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.537 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 69.9 mt -64.99 -50.66 73.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.515 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.562 HD13 ' HB3' ' A' ' 134' ' ' GLN . 44.7 mt -59.28 -58.92 4.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.86 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -51.01 -39.03 54.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.051 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.8 ttm -61.15 -39.41 89.99 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.89 0.376 . . . . 0.0 110.162 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 11.9 mm100 -62.01 -43.37 98.97 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.876 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.56 ' HG ' HD13 ' A' ' 131' ' ' LEU . 9.5 mp -58.87 -45.97 88.9 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.859 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.427 ' HG2' HH11 ' A' ' 185' ' ' ARG . 47.5 mtp85 -56.0 -44.35 78.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.42 HH11 ' HG2' ' A' ' 186' ' ' ARG . 12.1 tpt180 -60.9 -33.7 73.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.76 -48.77 73.34 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.646 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 188' ' ' LEU . 3.8 mm? -69.3 -44.4 71.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.581 -179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.2 mt-30 -62.11 -45.58 92.83 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.493 -179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.66 -45.39 90.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.444 -179.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.44 -50.68 72.61 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.052 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 73.2 mt-30 -69.61 138.14 52.87 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.836 179.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.514 ' O ' HD13 ' A' ' 193' ' ' LEU . 2.4 tm? -169.72 -45.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.424 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.558 ' HG2' ' H ' ' A' ' 195' ' ' ASN . 70.8 tt0 -68.77 -133.33 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.175 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.702 HD22 ' H ' ' A' ' 196' ' ' GLN . 0.0 OUTLIER -176.15 -39.53 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.169 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.85 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.702 ' H ' HD22 ' A' ' 195' ' ' ASN . 12.0 mm100 -72.09 129.81 39.4 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.954 0.407 . . . . 0.0 111.166 -179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -73.39 133.77 43.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.145 179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . 64.51 138.36 0.05 OUTLIER Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.485 179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 32.4 Cg_exo . . . . . 0 C--O 1.25 1.079 0 C-N-CA 122.46 2.107 . . . . 0.0 112.27 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 112.528 -0.229 . . . . 0.0 112.528 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.572 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 2.1 mp -63.99 -50.54 69.07 Favored Pre-proline 0 CA--C 1.533 0.315 0 O-C-N 123.026 -0.102 . . . . 0.0 111.222 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 37.3 Cg_endo -65.25 134.42 39.08 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 122.174 1.916 . . . . 0.0 112.125 179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.74 -39.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.294 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 74.1 p -141.33 -22.44 0.75 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.125 -179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.446 ' OD1' ' HA ' ' A' ' 121' ' ' PRO . 16.3 p-10 -49.31 -40.05 33.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.354 -179.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.0 mt -57.31 -43.35 83.2 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 110.873 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 46.9 t -58.3 -40.19 81.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.595 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.408 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 39.8 ttm180 -59.11 -44.33 91.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.052 179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 74.5 t -60.09 -50.67 79.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.602 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -40.9 95.79 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.091 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.55 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -60.84 -41.25 99.13 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.375 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.594 ' HB3' HD21 ' A' ' 184' ' ' LEU . 97.2 mt -67.79 -44.39 77.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.789 0.328 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 65.7 mm-40 -62.82 -47.61 82.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.713 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.65 -42.65 97.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.693 -0.23 . . . . 0.0 111.436 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 96.6 mm-40 -59.0 -52.05 67.45 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.674 0.273 . . . . 0.0 111.159 -179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.56 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 52.7 tp -52.15 -43.08 63.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.123 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.01 -40.99 86.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.218 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 141' ' ' VAL . 69.9 mt -60.05 -51.37 73.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.585 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.464 ' HG3' ' HE3' ' A' ' 176' ' ' LYS . 5.1 mp0 -60.57 -37.45 81.33 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.4 mt -59.67 -44.95 93.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.782 0.325 . . . . 0.0 111.06 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -67.91 -46.83 70.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.391 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 137' ' ' ILE . 59.0 t -63.01 -46.66 95.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.481 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.496 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 64.0 tttm -62.68 -45.81 91.04 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.801 -179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -60.66 -45.88 92.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.883 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -64.64 -39.98 97.16 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.662 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.564 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.44 -42.2 92.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 110.308 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.5 mt-10 -63.58 -40.63 97.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.677 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.67 -45.04 81.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.232 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 86.2 mtp -67.93 -42.02 81.68 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.003 179.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.564 HG13 ' O ' ' A' ' 145' ' ' ALA . 88.8 mt -58.39 -44.28 88.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.302 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.403 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.2 mt-30 -64.36 -46.35 83.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.456 -179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.453 HG22 ' OG1' ' A' ' 157' ' ' THR . 52.1 m -62.82 -50.66 70.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.062 -179.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.615 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.8 m-85 -65.29 -43.51 90.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.76 -178.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 48.1 t -57.21 -50.9 71.41 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.781 0.324 . . . . 0.0 110.552 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.52 HD22 ' N ' ' A' ' 155' ' ' GLY . 0.8 OUTLIER -71.28 134.22 46.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.031 179.519 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . 0.52 ' N ' HD22 ' A' ' 154' ' ' ASN . . . -55.37 113.63 3.96 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.55 -179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 83.2 p -179.58 -52.11 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.821 0.344 . . . . 0.0 110.619 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.549 HG22 ' H ' ' A' ' 158' ' ' LYS . 6.7 m -74.64 -131.36 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.193 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.549 ' H ' HG22 ' A' ' 157' ' ' THR . 7.8 ptpp? -179.3 -41.12 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.62 0.248 . . . . 0.0 111.49 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -55.8 97.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.983 0.421 . . . . 0.0 111.212 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 28.6 tpt180 -74.29 -45.56 46.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.174 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 58.7 mttp -54.84 -48.04 73.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.096 -179.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.577 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 90.7 mt -60.31 -36.84 78.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.796 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.615 HD13 ' HB2' ' A' ' 152' ' ' TYR . 47.9 tp -56.09 -44.81 79.37 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.946 0.403 . . . . 0.0 110.433 179.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.2 mt -60.93 -43.65 98.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.454 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 91.0 m -62.09 -41.38 98.13 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.054 179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . 0.411 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -59.09 -42.56 90.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.008 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -59.34 -44.93 92.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.055 179.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 2.9 tp-100 -62.08 -37.54 85.43 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.959 179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.481 ' HA ' ' CE ' ' A' ' 169' ' ' MET . 0.0 OUTLIER -58.07 -44.45 87.53 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.83 179.488 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.496 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 51.1 tp -65.37 -40.57 93.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.158 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -59.29 -46.29 88.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.442 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -65.03 -46.05 82.92 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.551 -179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.524 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -59.79 -47.4 85.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.605 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -58.52 -42.54 87.98 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.598 -179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.2 m -58.81 -50.6 73.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.744 0.307 . . . . 0.0 111.293 -179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.464 ' HE3' ' HG3' ' A' ' 138' ' ' GLU . 52.5 mtmt -57.7 -40.84 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.028 -179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 173' ' ' SER . 73.1 mt -61.58 -38.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.321 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -61.65 -50.55 72.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.389 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.447 ' N ' HD12 ' A' ' 179' ' ' ILE . 2.0 mp -64.87 -50.14 76.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.332 -179.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.511 ' O ' HD23 ' A' ' 184' ' ' LEU . 66.1 mt -59.14 -43.22 88.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.868 -179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 29.1 tpt180 -54.83 -43.11 72.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.596 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 47.0 tpp -59.0 -44.95 91.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.606 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -61.97 -36.18 80.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.94 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.594 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.6 mm? -69.25 -41.98 76.23 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.425 179.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 79.3 mtp180 -58.09 -51.8 68.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.409 ' HB3' ' NH1' ' A' ' 186' ' ' ARG . 3.7 ptp180 -63.35 -36.31 83.27 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.159 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.27 -44.36 96.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.363 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 84.7 mt -64.09 -43.28 95.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.211 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.1 mt-30 -59.9 -46.55 88.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.065 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.92 -43.02 99.93 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 62.9 t0 -62.13 -39.09 91.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.939 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 26.4 pt20 -165.48 139.21 4.59 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.183 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 51.5 tp -171.27 129.04 0.71 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.466 179.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.445 ' O ' ' HB3' ' A' ' 195' ' ' ASN . 57.9 mm-40 -69.84 -147.87 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.112 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.487 HD22 HE21 ' A' ' 196' ' ' GLN . 45.8 t30 72.51 -57.72 0.62 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.522 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.487 HE21 HD22 ' A' ' 195' ' ' ASN . 98.3 mm-40 -68.79 132.16 46.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -66.61 135.05 53.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.009 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 64.95 138.26 0.05 OUTLIER Pre-proline 0 CA--C 1.53 0.209 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.45 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo . . . . . 0 C--O 1.25 1.077 0 C-N-CA 122.585 2.19 . . . . 0.0 112.282 -179.945 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.495 -0.242 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.561 ' N ' HD12 ' A' ' 120' ' ' ILE . 2.8 mp 56.32 89.48 0.1 Allowed Pre-proline 0 C--N 1.331 -0.201 0 CA-C-O 120.714 0.292 . . . . 0.0 110.702 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -65.39 -145.42 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.744 2.296 . . . . 0.0 112.71 -179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.13 -122.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.395 -179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.428 ' O ' ' HG ' ' A' ' 125' ' ' LEU . 61.7 p 55.98 -144.81 0.65 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 122.527 0.331 . . . . 0.0 111.407 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.3 p30 45.25 34.29 1.41 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.324 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 123' ' ' THR . 99.6 mt -98.78 -42.27 7.27 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 45.7 t -57.74 -44.78 86.31 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.316 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.526 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 21.3 tpp180 -61.51 -47.27 86.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.208 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.59 -49.45 84.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.586 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.35 -40.45 90.8 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.409 -179.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.506 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -61.66 -42.33 99.74 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.394 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.6 ' HB3' HD22 ' A' ' 184' ' ' LEU . 83.2 mt -66.5 -44.19 83.25 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.841 0.353 . . . . 0.0 110.954 -179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -64.26 -47.1 80.87 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.967 -179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.628 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -57.53 -42.12 82.24 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.596 0.236 . . . . 0.0 110.944 -179.482 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.531 ' O ' ' HG2' ' A' ' 138' ' ' GLU . 3.4 mm100 -59.15 -43.68 92.08 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.798 0.332 . . . . 0.0 110.518 179.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 131' ' ' LEU . 89.9 mt -60.04 -40.93 91.09 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.005 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -60.54 -47.37 86.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.164 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -58.78 -38.93 75.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.811 179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.637 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.9 mm-40 -59.44 -46.58 88.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.235 179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 90.4 mt -59.76 -39.81 86.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.274 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -61.46 -47.77 84.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.138 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.4 -47.1 68.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.633 -179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.509 ' HE3' ' HD3' ' A' ' 174' ' ' LYS . 87.2 tttt -58.45 -49.51 77.05 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.191 -179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -59.71 -43.68 94.01 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.562 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.725 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -58.09 -41.38 94.55 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.367 179.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.463 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.36 -40.97 94.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.056 0.455 . . . . 0.0 110.145 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 150' ' ' GLN . 56.6 mt-10 -62.75 -40.02 95.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.469 179.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.725 HD22 ' HA2' ' A' ' 144' ' ' GLY . 80.2 m-20 -58.03 -45.44 86.94 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.756 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 44.3 mtm -64.78 -47.23 78.87 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.938 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 145' ' ' ALA . 75.5 mt -55.21 -45.58 77.54 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.03 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 146' ' ' GLU . 85.4 mt-30 -64.54 -40.8 96.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.781 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.453 HG22 ' OG1' ' A' ' 157' ' ' THR . 85.1 m -60.33 -45.57 92.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.242 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.412 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 2.0 m-30 -66.29 -44.53 83.24 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.936 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 80.0 p -66.13 -24.17 66.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.017 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -50.93 -63.15 1.22 Allowed 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.41 -179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 160.49 -48.72 0.38 Allowed Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.309 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -60.11 -71.11 0.14 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.672 0.272 . . . . 0.0 111.252 -179.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.453 ' OG1' HG22 ' A' ' 151' ' ' THR . 76.2 p -73.01 136.94 45.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.617 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -147.85 40.19 0.97 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.642 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.402 ' O ' ' HB2' ' A' ' 163' ' ' LEU . 1.5 m-20 -68.31 118.95 12.07 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 179.193 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 11.8 tpt180 -73.69 -45.0 55.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.719 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.486 ' HD2' ' N ' ' A' ' 161' ' ' LYS . 0.7 OUTLIER -56.98 -51.41 69.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.325 -179.488 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 10.4 mp -70.57 -31.66 68.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.589 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.402 ' HB2' ' O ' ' A' ' 159' ' ' ASP . 65.0 tp -56.59 -52.02 66.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.837 0.351 . . . . 0.0 110.417 179.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.5 mt -64.73 -39.38 93.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.014 179.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.424 ' O ' ' HG2' ' A' ' 169' ' ' MET . 92.7 m -58.48 -39.94 81.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.669 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.28 -43.59 94.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.777 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -56.89 -44.47 82.33 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.293 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.3 tp60 -62.35 -38.29 88.93 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.291 179.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 165' ' ' THR . 77.9 mmm -63.03 -49.96 72.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.138 179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.494 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.2 tm? -58.03 -46.6 85.05 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.609 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -64.94 -40.87 95.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.179 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -60.2 -47.63 85.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.31 -179.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.541 ' O ' HG13 ' A' ' 177' ' ' ILE . 84.2 p -60.27 -44.32 95.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.154 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.583 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.93 -42.16 84.28 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.202 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.2 m -60.45 -47.26 86.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.143 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -62.21 -43.16 99.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.932 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.637 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.9 mt -60.83 -44.14 97.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.283 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -56.41 -43.39 79.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.912 0.387 . . . . 0.0 110.334 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.497 ' O ' ' HG3' ' A' ' 183' ' ' GLN . 68.2 mt -61.73 -44.8 99.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.819 179.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.43 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 70.2 mt -61.08 -45.81 97.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.436 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HA ' ' HG ' ' A' ' 184' ' ' LEU . 29.2 tpt180 -53.71 -46.98 70.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.77 0.319 . . . . 0.0 110.813 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.6 mmt -59.24 -38.94 81.23 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.288 179.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 179' ' ' ILE . 84.7 mt-30 -64.85 -36.34 84.04 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.028 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.6 HD22 ' HB3' ' A' ' 131' ' ' LEU . 9.4 mt -60.19 -50.87 71.97 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.185 0.517 . . . . 0.0 110.818 -179.577 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 99.3 mtt180 -61.64 -45.82 92.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.14 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.401 ' HA ' ' CG ' ' A' ' 189' ' ' GLN . 79.8 ttt180 -66.44 -33.85 76.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.208 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -65.33 -40.52 93.8 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.765 -179.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 31.9 tp -72.55 -47.38 48.68 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.555 ' HB2' HD12 ' A' ' 193' ' ' LEU . 14.1 pt20 -58.15 -49.29 77.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.924 0.392 . . . . 0.0 111.72 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -64.34 -42.73 96.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.407 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.16 -36.39 81.69 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.94 0.4 . . . . 0.0 110.521 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -168.46 140.31 2.78 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.87 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.555 HD12 ' HB2' ' A' ' 189' ' ' GLN . 1.0 OUTLIER -168.89 47.22 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.111 0.481 . . . . 0.0 110.098 179.898 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -72.44 -50.52 25.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.975 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -68.43 136.53 53.41 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.819 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -60.48 139.16 57.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.011 -179.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.27 129.2 39.33 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.19 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -175.85 55.86 0.14 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.212 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--O 1.249 1.029 0 C-N-CA 122.392 2.061 . . . . 0.0 112.352 -179.978 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.486 -0.246 . . . . 0.0 112.486 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 46.5 mm -64.11 122.62 78.58 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.61 0.243 . . . . 0.0 111.176 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -74.03 -45.15 0.38 Allowed 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.474 2.116 . . . . 0.0 111.998 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -173.35 129.12 0.45 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.936 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 92.4 m -165.21 -36.17 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.175 179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.3 p-10 -57.89 -39.02 76.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.984 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.743 HD12 ' N ' ' A' ' 126' ' ' SER . 3.8 pp -56.92 -31.74 65.23 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.096 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.743 ' N ' HD12 ' A' ' 125' ' ' LEU . 49.6 m -60.1 -42.18 94.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.874 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 23.2 tpp180 -59.97 -47.02 87.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.705 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -63.14 -40.04 87.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.974 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.45 -42.39 98.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.123 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.807 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -64.34 -46.94 89.25 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.836 -0.697 . . . . 0.0 112.702 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.471 ' HB3' HD22 ' A' ' 184' ' ' LEU . 79.6 mt -66.86 -41.13 87.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.997 0.427 . . . . 0.0 111.06 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -62.55 -48.35 79.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.807 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 64.5 pttt -60.62 -40.5 92.11 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.546 0.212 . . . . 0.0 111.118 -179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.4 mm-40 -58.55 -44.56 89.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.893 179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.579 HD21 HD11 ' A' ' 184' ' ' LEU . 95.6 mt -60.21 -42.2 94.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.909 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.09 -45.3 95.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.08 179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.508 ' O ' HG23 ' A' ' 141' ' ' VAL . 67.5 mt -62.26 -42.85 96.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.101 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.684 ' HB3' HD11 ' A' ' 177' ' ' ILE . 59.3 mm-40 -59.29 -45.96 89.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.327 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 98.6 mt -58.72 -41.55 86.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.009 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -64.99 -45.74 84.38 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.164 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 137' ' ' ILE . 62.1 t -65.2 -46.08 91.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.484 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.477 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.5 tttm -63.69 -47.15 82.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.102 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.696 HE21 HD21 ' A' ' 147' ' ' ASN . 70.7 tp60 -60.71 -45.27 94.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.607 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -65.77 -35.18 90.6 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.421 179.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.558 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -67.23 -43.64 81.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.993 0.425 . . . . 0.0 110.53 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.8 mt-10 -60.94 -41.18 95.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.784 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.696 HD21 HE21 ' A' ' 143' ' ' GLN . 3.7 m120 -59.0 -46.14 88.91 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.636 179.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.468 ' O ' ' HD1' ' A' ' 152' ' ' TYR . 83.3 mtp -63.44 -47.07 83.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.921 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.558 HG13 ' O ' ' A' ' 145' ' ' ALA . 83.1 mt -53.01 -47.92 53.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.987 -179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -67.42 -35.88 80.14 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.121 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.566 HG22 HG21 ' A' ' 157' ' ' THR . 98.8 m -58.18 -52.7 64.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.137 -0.483 . . . . 0.0 112.064 -179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.759 ' HB2' HD13 ' A' ' 163' ' ' LEU . 21.3 m-85 -74.67 -47.34 32.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.706 0.288 . . . . 0.0 111.377 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 53.1 m -62.14 131.8 50.72 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.39 . . . . 0.0 111.442 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 55.37 44.34 27.39 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.66 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 173.69 128.74 1.1 Allowed Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.08 179.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 80.0 p -69.78 140.85 53.44 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.607 0.241 . . . . 0.0 110.385 179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.566 HG21 HG22 ' A' ' 151' ' ' THR . 5.8 t -169.15 -41.92 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.751 -179.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.716 ' HG2' ' H ' ' A' ' 159' ' ' ASP . 4.1 ttmp? -170.67 -179.77 3.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.62 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.716 ' H ' ' HG2' ' A' ' 158' ' ' LYS . 60.1 m-20 -54.55 142.36 28.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.107 0.479 . . . . 0.0 111.926 -179.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 39.7 mmt180 -64.24 -22.15 66.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.551 -0.749 . . . . 0.0 111.13 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 25.8 ttpp -52.8 -42.23 64.87 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.063 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.471 ' HB2' ' CE2' ' A' ' 152' ' ' TYR . 3.6 mm? -65.55 -40.0 92.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.512 -0.313 . . . . 0.0 110.601 179.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.759 HD13 ' HB2' ' A' ' 152' ' ' TYR . 56.0 tp -57.22 -44.53 83.82 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.542 179.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.38 -41.25 96.81 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.248 179.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.432 ' O ' ' HG3' ' A' ' 169' ' ' MET . 85.1 m -59.56 -42.95 93.59 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.588 179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.94 83.23 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.711 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.37 -45.82 90.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.277 179.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -38.78 88.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.454 179.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.432 ' HG3' ' O ' ' A' ' 165' ' ' THR . 73.3 mtp -59.94 -48.36 82.02 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.032 179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 57.2 tp -58.42 -46.2 86.95 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.256 -179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.87 -43.96 94.52 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.259 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -61.69 -45.78 92.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.164 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.57 ' HA ' ' NZ ' ' A' ' 176' ' ' LYS . 80.8 p -61.04 -45.55 94.31 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.89 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 58.2 mtpt -59.89 -38.66 82.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.018 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.8 m -58.61 -48.05 82.27 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.963 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.57 ' NZ ' ' HA ' ' A' ' 173' ' ' SER . 37.3 mtmm -63.53 -40.54 97.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.876 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.684 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.2 mt -60.32 -40.16 83.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.209 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -61.92 -47.35 85.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.835 0.35 . . . . 0.0 110.526 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.408 ' O ' ' HG2' ' A' ' 183' ' ' GLN . 63.1 mt -62.73 -48.59 87.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.016 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.502 ' O ' ' HG ' ' A' ' 184' ' ' LEU . 64.5 mt -60.68 -40.09 83.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.605 179.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.1 ttt180 -53.87 -45.14 70.94 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.352 179.641 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.1 tpp -61.52 -39.85 92.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.186 179.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 179' ' ' ILE . 9.9 mm100 -62.05 -43.07 99.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.145 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.579 HD11 HD21 ' A' ' 135' ' ' LEU . 9.3 mt -58.75 -51.15 71.19 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.104 0.478 . . . . 0.0 110.624 -179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.478 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 44.5 mmm-85 -57.2 -41.83 80.14 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.789 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.407 HH11 ' HG2' ' A' ' 186' ' ' ARG . 52.7 ttp85 -64.12 -37.01 85.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.414 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.12 -46.57 88.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.492 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.409 HD23 ' O ' ' A' ' 184' ' ' LEU . 4.1 mm? -65.62 -42.22 91.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.458 -179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 26.5 mt-30 -61.22 -44.06 97.88 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.606 -179.578 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -65.49 -52.62 51.5 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -64.31 -45.39 88.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.786 0.327 . . . . 0.0 111.521 -179.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -79.44 42.77 0.52 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.019 -179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.467 ' C ' HD13 ' A' ' 193' ' ' LEU . 2.7 tm? -174.34 122.03 0.28 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.256 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.431 ' N ' HD13 ' A' ' 193' ' ' LEU . 43.7 tt0 58.64 115.61 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.356 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 45.5 t30 -74.4 131.45 41.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.693 179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.735 ' NE2' ' H ' ' A' ' 196' ' ' GLN . 0.0 OUTLIER -64.65 139.66 58.79 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.334 -0.393 . . . . 0.0 110.575 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.08 136.4 52.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.964 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 199' ' ' PRO . . . -167.8 136.97 2.08 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.205 -179.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 198' ' ' ALA . 39.2 Cg_exo . . . . . 0 C--O 1.248 1.021 0 C-N-CA 122.568 2.179 . . . . 0.0 112.318 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.216 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.922 HD12 ' HD2' ' A' ' 121' ' ' PRO . 6.6 tp -174.13 124.1 0.4 Allowed Pre-proline 0 CA--C 1.532 0.257 0 CA-C-O 120.705 0.288 . . . . 0.0 111.029 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.922 ' HD2' HD12 ' A' ' 120' ' ' ILE . 29.6 Cg_endo -63.45 141.98 83.07 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.452 2.101 . . . . 0.0 111.904 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -54.06 119.45 5.09 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.127 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 99.1 m -167.33 -47.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.664 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.563 ' HA ' HH12 ' A' ' 127' ' ' ARG . 3.2 m120 -61.24 -36.95 81.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.976 179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.9 mt -54.46 -39.52 67.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.056 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 47.8 t -61.12 -44.93 96.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.804 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.563 HH12 ' HA ' ' A' ' 124' ' ' ASN . 18.3 ttp-105 -66.05 -46.2 78.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.082 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 132' ' ' GLU . 73.7 t -59.14 -50.51 79.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.418 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.07 85.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.269 -179.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.84 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.14 -44.19 98.46 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.342 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.673 HD13 ' HG ' ' A' ' 184' ' ' LEU . 74.1 mt -66.83 -42.73 85.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.895 0.379 . . . . 0.0 110.882 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.456 ' HG3' ' O ' ' A' ' 128' ' ' VAL . 56.5 mt-10 -62.86 -48.42 79.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.923 -179.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.84 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.7 pttp -59.48 -40.59 87.47 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.013 -179.359 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.589 HE21 ' NZ ' ' A' ' 133' ' ' LYS . 88.0 mm-40 -58.2 -44.71 88.23 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.83 0.348 . . . . 0.0 110.797 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.452 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.6 mt -60.39 -44.66 95.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.29 95.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.319 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 133' ' ' LYS . 74.7 mt -59.79 -42.27 88.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.074 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.638 ' HB3' HD11 ' A' ' 177' ' ' ILE . 66.4 mm-40 -62.41 -41.73 98.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.369 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 98.3 mt -60.42 -40.21 90.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.372 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -63.55 -48.76 76.16 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.363 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 49.0 t -67.82 -47.29 80.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.565 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.489 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 63.4 tttm -59.36 -46.6 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.087 -179.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -62.04 -46.28 89.85 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.645 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.618 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -60.6 -35.29 89.02 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.966 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.475 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.72 -40.5 92.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.872 0.367 . . . . 0.0 110.125 179.522 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 94.9 mt-10 -60.23 -42.44 95.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.546 179.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.618 HD22 ' HA2' ' A' ' 144' ' ' GLY . 77.2 m-20 -59.69 -45.89 90.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.835 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 88.5 mmm -67.72 -44.29 77.98 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.249 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.609 HD12 HD12 ' A' ' 170' ' ' LEU . 91.2 mt -61.8 -46.62 96.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.674 -179.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 98.7 mm-40 -64.76 -42.91 94.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.816 0.341 . . . . 0.0 111.204 -179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.675 HG22 ' OG1' ' A' ' 157' ' ' THR . 99.5 m -63.34 -48.6 77.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.494 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.527 ' HE2' ' HB3' ' A' ' 162' ' ' LEU . 2.1 m-30 -69.15 -40.4 78.24 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.994 -179.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 79.7 p -54.49 -36.78 64.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.536 -179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -158.12 133.26 8.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.95 0.405 . . . . 0.0 111.169 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 133.96 -141.62 12.98 Favored Glycine 0 N--CA 1.45 -0.37 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.104 -179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 50.0 m -71.3 -51.29 25.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.071 0.462 . . . . 0.0 110.173 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.675 ' OG1' HG22 ' A' ' 151' ' ' THR . 75.0 p -82.84 142.65 31.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.875 179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . 0.431 ' HA ' ' O ' ' A' ' 152' ' ' TYR . 18.5 ptpt -166.95 38.58 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.357 . . . . 0.0 111.387 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.499 ' HB3' ' HB2' ' A' ' 162' ' ' LEU . 9.9 t0 -72.53 131.06 42.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 109.943 179.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 36.1 mmt180 -68.29 -48.71 64.23 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -59.25 -49.76 76.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.935 0.398 . . . . 0.0 110.477 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.527 ' HB3' ' HE2' ' A' ' 152' ' ' TYR . 94.1 mt -63.26 -35.5 80.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.544 179.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.562 HD13 ' C ' ' A' ' 163' ' ' LEU . 3.1 tm? -54.49 -58.04 9.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.934 179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.0 mt -54.73 -37.09 65.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.707 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.444 ' O ' ' HG3' ' A' ' 169' ' ' MET . 87.4 m -57.54 -50.17 73.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -64.26 -41.21 97.04 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.975 0.417 . . . . 0.0 110.871 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.439 ' OE1' HD13 ' A' ' 149' ' ' ILE . 14.1 mm-40 -57.12 -44.72 83.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.394 179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.7 tp60 -63.72 -37.57 87.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.254 179.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.444 ' HG3' ' O ' ' A' ' 165' ' ' THR . 74.5 mtp -61.15 -50.77 71.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.445 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.609 HD12 HD12 ' A' ' 149' ' ' ILE . 3.5 tt -64.7 -46.74 81.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.682 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.479 ' HA ' ' HE2' ' A' ' 174' ' ' LYS . 8.3 tt0 -56.49 -44.55 80.76 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.199 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.413 ' O ' ' HG3' ' A' ' 176' ' ' LYS . 34.5 t70 -62.15 -42.12 98.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.034 -179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.548 ' O ' HG13 ' A' ' 177' ' ' ILE . 59.9 m -59.69 -48.19 82.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.374 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.479 ' HE2' ' HA ' ' A' ' 171' ' ' GLN . 55.2 mtmt -57.22 -49.27 76.55 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 111.38 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.4 m -55.59 -46.9 77.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.296 -179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.505 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 53.6 mtmt -59.6 -40.94 89.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.883 0.373 . . . . 0.0 110.561 179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.638 HD11 ' HB3' ' A' ' 138' ' ' GLU . 65.4 mt -63.9 -38.45 82.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.015 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 62.5 m-20 -57.57 -48.33 79.65 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.911 0.386 . . . . 0.0 110.353 179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 69.8 mt -60.56 -40.25 83.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.36 179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.47 ' O ' HD13 ' A' ' 184' ' ' LEU . 56.5 mt -57.45 -55.59 20.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.094 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 42.1 ttt85 -51.21 -40.04 57.87 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.007 -179.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.413 ' O ' ' HG3' ' A' ' 185' ' ' ARG . 80.6 mtp -60.03 -39.42 85.83 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.304 179.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -68.03 -43.15 79.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.673 ' HG ' HD13 ' A' ' 131' ' ' LEU . 10.0 mp -62.78 -49.58 74.44 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.365 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.697 ' HD3' ' N ' ' A' ' 186' ' ' ARG . 0.0 OUTLIER -60.73 -36.45 78.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.724 0.297 . . . . 0.0 110.451 179.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.697 ' N ' ' HD3' ' A' ' 185' ' ' ARG . 22.4 tpp180 -65.28 -42.37 93.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.153 179.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -62.79 -37.29 86.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.787 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 24.7 tp -68.04 -48.12 66.52 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.064 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 12.0 mm100 -58.97 -42.69 90.56 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.985 0.421 . . . . 0.0 110.611 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -68.27 -37.17 80.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.781 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 65.5 t0 -56.12 -53.81 52.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.458 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -67.1 -28.98 68.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.966 179.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 58.0 tp -68.09 73.09 0.19 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.139 179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.816 ' HB2' HE22 ' A' ' 196' ' ' GLN . 24.7 pt-20 40.48 -145.19 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.564 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 19.5 p30 -174.14 -44.38 0.01 OUTLIER 'General case' 0 C--O 1.231 0.105 0 CA-C-O 120.6 0.238 . . . . 0.0 111.223 179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.816 HE22 ' HB2' ' A' ' 194' ' ' GLU . 3.2 pm0 -71.52 137.56 48.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.786 0.327 . . . . 0.0 110.849 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.72 133.21 55.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.144 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 64.26 133.22 0.03 OUTLIER Pre-proline 0 C--N 1.333 -0.145 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.446 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo . . . . . 0 C--O 1.249 1.043 0 C-N-CA 122.556 2.171 . . . . 0.0 112.232 179.971 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . 0.593 ' N ' ' HB2' ' A' ' 126' ' ' SER . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.616 -0.194 . . . . 0.0 112.616 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.657 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 49.1 mm -59.42 -47.5 97.85 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 111.637 0.236 . . . . 0.0 111.637 179.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.657 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 11.7 Cg_endo -55.16 154.3 23.37 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.471 2.114 . . . . 0.0 112.264 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.544 ' HB3' HD23 ' A' ' 125' ' ' LEU . . . 68.83 47.64 0.8 Allowed 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.288 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 82.6 p 49.75 45.44 24.63 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.979 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 55.56 58.59 4.44 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.242 179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.74 HD12 ' N ' ' A' ' 126' ' ' SER . 3.0 pp -53.38 -24.83 13.31 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.257 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.74 ' N ' HD12 ' A' ' 125' ' ' LEU . 43.4 t -56.08 -46.54 78.98 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.255 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -60.44 -44.71 95.54 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.949 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.491 HG12 ' OE2' ' A' ' 132' ' ' GLU . 50.8 t -59.68 -44.02 92.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.11 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 133' ' ' LYS . . . -62.55 -41.18 98.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.099 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -61.49 -39.77 97.78 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.821 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.679 ' O ' ' HG2' ' A' ' 134' ' ' GLN . 84.8 mt -70.71 -38.74 73.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.722 0.296 . . . . 0.0 111.192 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.491 ' OE2' HG12 ' A' ' 128' ' ' VAL . 49.6 mt-10 -67.28 -48.31 68.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.934 0.397 . . . . 0.0 110.518 179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.495 ' O ' HG13 ' A' ' 137' ' ' ILE . 22.0 ptmt -63.45 -41.71 98.65 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.187 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.894 ' HG3' HD13 ' A' ' 180' ' ' ILE . 1.5 pt20 -60.41 -43.11 97.04 Favored 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 120.897 0.38 . . . . 0.0 110.206 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' ' 135' ' ' LEU . 3.0 tm? -54.25 -42.16 69.61 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 178.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -64.76 -37.04 86.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.279 -0.873 . . . . 0.0 110.765 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.639 HD12 ' HA ' ' A' ' 134' ' ' GLN . 69.0 mt -53.37 -49.46 53.31 Favored 'Isoleucine or valine' 0 C--O 1.231 0.131 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.72 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.572 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -61.69 -45.96 91.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.535 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 87.9 mt -56.47 -38.21 71.38 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.379 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 98.3 mttt -63.45 -51.37 65.95 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.254 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 46.9 t -64.92 -44.18 96.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.246 -179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.457 ' HG3' ' CD1' ' A' ' 170' ' ' LEU . 62.7 tttp -59.23 -46.14 89.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.016 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -61.72 -42.3 98.78 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.869 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.58 -41.13 97.14 Favored Glycine 0 C--N 1.33 0.216 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.585 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.63 -44.59 81.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.891 0.377 . . . . 0.0 110.293 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 150' ' ' GLN . 50.3 mt-10 -60.19 -40.27 89.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.737 179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -57.93 -47.95 81.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.926 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 60.3 mtm -67.94 -42.32 81.18 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.262 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.585 HG13 ' O ' ' A' ' 145' ' ' ALA . 96.2 mt -53.93 -46.88 64.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.78 0.324 . . . . 0.0 111.311 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 95.4 mm-40 -65.2 -39.77 93.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.184 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 85.6 m -64.68 -46.25 83.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.902 -179.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.724 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.9 m-85 -65.91 -42.15 90.55 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.985 -179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 88.0 p -52.03 -43.64 63.82 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.59 0.233 . . . . 0.0 110.897 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . 0.517 HD22 ' N ' ' A' ' 155' ' ' GLY . 0.7 OUTLIER -175.46 124.95 0.23 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.848 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . 0.517 ' N ' HD22 ' A' ' 154' ' ' ASN . . . 168.67 -56.28 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.691 179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.3 t -179.86 45.13 0.0 OUTLIER 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.814 0.34 . . . . 0.0 110.649 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.704 HG23 ' HA ' ' A' ' 152' ' ' TYR . 9.2 t -175.34 159.28 2.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.042 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 9.0 ptpp? -149.31 24.65 0.9 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.078 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -75.83 71.83 2.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.182 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' A' ' 163' ' ' LEU . 38.8 ttm180 -53.42 -30.22 39.17 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.903 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.478 ' HD3' ' C ' ' A' ' 161' ' ' LYS . 7.3 tmtm? -53.28 -55.48 24.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.015 0.436 . . . . 0.0 109.964 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.724 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 92.9 mt -64.27 -32.68 74.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.216 179.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.571 ' O ' ' HG2' ' A' ' 167' ' ' GLN . 47.8 tp -56.33 -51.9 66.55 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.31 179.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.58 -42.85 79.35 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 89.4 m -56.55 -41.79 77.46 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.202 0.525 . . . . 0.0 109.661 178.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -69.74 -37.51 76.51 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.507 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.571 ' HG2' ' O ' ' A' ' 163' ' ' LEU . 14.2 mm100 -56.45 -44.35 80.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.138 179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 70.0 tp60 -65.69 -40.19 92.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.124 179.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.8 mtp -56.73 -47.58 79.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.989 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.458 ' O ' ' HG3' ' A' ' 174' ' ' LYS . 54.5 tp -60.32 -45.49 93.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.323 -179.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.68 -47.05 87.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.037 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.19 -40.8 97.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.812 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 177' ' ' ILE . 48.8 m -59.97 -45.87 91.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.909 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 28.5 mtpp -58.84 -41.25 86.48 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.977 179.863 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 86.6 m -58.77 -44.32 90.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.739 179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -62.58 -41.53 99.0 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.632 179.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.572 HG12 ' HB3' ' A' ' 138' ' ' GLU . 62.1 mt -58.56 -42.9 85.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.972 179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . 0.495 ' HA ' ' HE ' ' A' ' 181' ' ' ARG . 27.2 m-20 -61.44 -41.01 96.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.33 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 67.5 mt -62.86 -44.12 99.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.127 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.894 HD13 ' HG3' ' A' ' 134' ' ' GLN . 53.5 mt -58.74 -48.79 84.92 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.806 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.495 ' HE ' ' HA ' ' A' ' 178' ' ' ASP . 84.8 mtm180 -53.96 -40.8 67.15 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.563 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.488 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 25.8 mmt -60.05 -46.54 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.565 179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -59.4 -41.98 90.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.911 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.659 HD23 ' O ' ' A' ' 180' ' ' ILE . 4.3 mm? -61.05 -42.31 98.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.201 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.423 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 71.3 mtt-85 -58.01 -51.27 70.37 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.48 ' HD3' ' O ' ' A' ' 182' ' ' MET . 10.5 mpt_? -66.04 -36.81 84.24 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.812 179.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -59.46 -42.72 92.67 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.919 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 94.1 mt -63.84 -44.0 94.49 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.732 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -60.86 -45.26 95.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.207 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -61.65 -47.51 85.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.35 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -62.78 -44.28 96.58 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.011 -179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -78.3 43.4 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.468 -179.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.519 HD13 ' N ' ' A' ' 194' ' ' GLU . 3.0 tm? -174.05 127.56 0.37 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.377 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.519 ' N ' HD13 ' A' ' 193' ' ' LEU . 56.9 mt-10 -153.66 -144.42 0.15 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.564 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -68.77 137.94 54.42 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.768 0.318 . . . . 0.0 110.921 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.733 ' NE2' ' H ' ' A' ' 196' ' ' GLN . 0.0 OUTLIER -58.71 138.04 57.28 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.814 179.936 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.38 133.51 55.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.136 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -64.24 137.84 97.24 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.088 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo . . . . . 0 C--O 1.248 1.005 0 C-N-CA 122.595 2.197 . . . . 0.0 112.163 179.952 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.151 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.541 ' N ' ' HD3' ' A' ' 121' ' ' PRO . 31.3 pt 37.75 56.4 4.31 Favored Pre-proline 0 N--CA 1.466 0.335 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.541 ' HD3' ' N ' ' A' ' 120' ' ' ILE . 21.4 Cg_exo -65.41 -142.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.571 2.181 . . . . 0.0 112.194 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.78 -57.02 7.02 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.096 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 82.1 p -78.68 117.35 19.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.042 179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 128' ' ' VAL . 44.0 t30 177.41 -48.15 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.104 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 93.5 mt -61.55 -45.3 94.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.571 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 48.4 t -62.26 -45.72 92.04 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.517 -179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -63.81 -45.21 90.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.565 -179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 124' ' ' ASN . 69.2 t -61.27 -48.28 89.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.581 -0.282 . . . . 0.0 111.677 -179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.05 -43.97 95.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.569 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.592 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -65.07 -48.53 69.75 Favored Glycine 0 C--N 1.331 0.26 0 C-N-CA 120.646 -0.787 . . . . 0.0 112.909 -179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.664 ' HB3' HD21 ' A' ' 184' ' ' LEU . 90.3 mt -64.94 -41.59 95.38 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.924 0.393 . . . . 0.0 111.31 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -61.09 -51.09 70.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.864 -179.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 14.8 ptmm? -59.48 -39.21 83.0 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.239 -179.5 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 97.5 mm-40 -58.21 -44.44 88.14 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.713 0.292 . . . . 0.0 110.999 179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.483 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 96.8 mt -58.77 -44.13 90.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.306 -179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.75 84.19 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.436 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 68.7 mt -59.09 -42.49 86.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.354 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.729 ' HB3' HD11 ' A' ' 177' ' ' ILE . 4.7 mm-40 -60.06 -43.44 95.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.32 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 88.5 mt -58.42 -43.07 88.54 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.051 -179.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -59.77 -48.45 81.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.508 -179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.8 t -68.61 -46.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 -179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.524 ' NZ ' HD12 ' A' ' 177' ' ' ILE . 37.4 ttmt -59.25 -49.23 78.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.399 -179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -63.36 -42.34 98.88 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.809 0.338 . . . . 0.0 110.784 179.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -59.79 -39.16 94.99 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.947 179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.52 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -64.63 -40.05 94.78 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.106 0.479 . . . . 0.0 109.92 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 142' ' ' LYS . 64.8 mm-40 -59.81 -39.42 84.95 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.341 179.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.61 -44.05 96.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.231 179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 80.5 mtp -67.09 -41.31 86.54 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.228 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.52 HG13 ' O ' ' A' ' 145' ' ' ALA . 80.0 mt -61.14 -49.26 85.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.667 -179.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 98.4 mm-40 -68.98 -44.14 73.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.831 -179.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 93.6 m -64.66 -47.09 79.75 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.752 0.311 . . . . 0.0 111.46 -179.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.457 ' HD1' ' N ' ' A' ' 152' ' ' TYR . 1.4 m-30 -74.87 9.12 2.03 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.578 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 73.4 m -67.35 -49.4 64.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.641 0.258 . . . . 0.0 111.023 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 74.6 m-80 -157.44 -49.87 0.07 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.76 179.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -64.93 144.38 48.01 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.367 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.0 t 61.45 -117.1 0.67 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.282 0.087 . . . . 0.0 110.853 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 89.5 m -51.27 128.57 22.58 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.923 0.392 . . . . 0.0 111.252 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -102.48 -37.78 7.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.051 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -55.15 111.92 0.96 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.476 -179.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.933 ' HG3' HD23 ' A' ' 163' ' ' LEU . 55.2 ttp180 -74.85 -12.49 60.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.092 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -52.58 -50.3 63.26 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.862 0.363 . . . . 0.0 110.435 -179.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.425 ' N ' HD22 ' A' ' 162' ' ' LEU . 3.7 mm? -67.24 -33.85 76.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.001 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.933 HD23 ' HG3' ' A' ' 160' ' ' ARG . 61.1 tp -56.57 -44.62 81.15 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.418 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 91.2 mt -63.98 -44.82 91.57 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.606 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 88.1 m -58.98 -43.12 91.33 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.916 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 169' ' ' MET . . . -60.47 -41.23 93.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.874 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 74.0 mt-30 -59.14 -42.76 91.42 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.164 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 4.7 tm0? -59.22 -41.22 88.12 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.436 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.43 ' HB2' ' O ' ' A' ' 166' ' ' ALA . 71.6 mmm -56.42 -45.98 80.45 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.624 179.181 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.508 ' CD1' ' HG3' ' A' ' 142' ' ' LYS . 56.9 tp -58.28 -44.64 88.55 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.047 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -58.45 -43.75 88.94 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.382 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -60.48 -47.2 87.18 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.255 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.538 ' O ' HG13 ' A' ' 177' ' ' ILE . 80.5 p -64.48 -45.41 87.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.541 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.506 ' HG3' ' O ' ' A' ' 170' ' ' LEU . 29.4 mtpp -57.17 -44.16 83.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.48 -179.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 85.9 m -59.16 -50.16 75.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.382 . . . . 0.0 111.047 -179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -59.21 -42.25 90.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.869 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.729 HD11 ' HB3' ' A' ' 138' ' ' GLU . 59.3 mt -62.07 -34.6 64.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.028 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -61.2 -50.75 71.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.662 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . 0.443 ' N ' HD12 ' A' ' 179' ' ' ILE . 1.8 mp -62.79 -47.23 93.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.82 179.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.485 ' O ' HD23 ' A' ' 184' ' ' LEU . 70.4 mt -58.51 -44.15 88.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.763 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.419 ' HG3' HH11 ' A' ' 181' ' ' ARG . 29.9 tpt85 -53.81 -42.81 68.78 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.345 179.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 26.5 mmt -60.78 -38.9 86.9 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.5 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.5 mm100 -64.15 -45.22 89.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.042 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.664 HD21 ' HB3' ' A' ' 131' ' ' LEU . 4.4 mm? -61.67 -53.17 59.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.623 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.502 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 16.0 ptp180 -57.69 -39.55 77.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.63 -179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -63.28 -39.94 96.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.703 179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -61.9 -44.12 97.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.218 -179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 184' ' ' LEU . 10.1 mp -65.87 -41.84 91.1 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.441 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 12.3 mm100 -61.53 -45.92 92.15 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.748 0.309 . . . . 0.0 111.161 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -66.51 -49.78 65.39 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.782 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -65.88 -58.62 5.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.17 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -69.76 121.36 17.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.021 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.548 HD22 ' H ' ' A' ' 194' ' ' GLU . 0.9 OUTLIER 179.88 -133.3 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 179.869 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.548 ' H ' HD22 ' A' ' 193' ' ' LEU . 23.9 pt-20 -170.8 -45.29 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.766 0.317 . . . . 0.0 110.518 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.538 ' H ' HD22 ' A' ' 193' ' ' LEU . 0.7 OUTLIER -178.91 128.91 0.11 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.301 179.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.525 ' N ' HD22 ' A' ' 195' ' ' ASN . 3.3 pp0? -64.75 142.89 58.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.189 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -60.96 133.89 56.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.04 -179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -172.91 138.44 0.85 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.053 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo . . . . . 0 C--O 1.249 1.06 0 C-N-CA 122.549 2.166 . . . . 0.0 112.226 179.797 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.213 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.603 ' N ' ' HD2' ' A' ' 121' ' ' PRO . 68.1 mt -60.05 -49.53 90.61 Favored Pre-proline 0 CA--C 1.533 0.307 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 120' ' ' ILE . 25.9 Cg_endo -62.07 141.54 89.17 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 122.268 1.979 . . . . 0.0 112.189 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . 66.69 148.37 0.05 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.337 -179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 19.9 m 66.4 53.29 1.0 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.761 -179.677 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.627 ' HB2' HG21 ' A' ' 128' ' ' VAL . 16.0 p-10 -171.91 129.94 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.519 179.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 96.4 mt -152.71 -132.23 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.913 -179.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.0 p -52.96 -36.1 59.69 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.43 -179.673 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.465 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 47.6 ttm-85 -57.49 -49.41 76.39 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.157 -179.744 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.627 HG21 ' HB2' ' A' ' 124' ' ' ASN . 61.7 t -65.63 -52.05 55.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.894 -179.688 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.19 -39.27 75.05 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.374 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.587 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.84 -44.6 97.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.481 179.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 184' ' ' LEU . 87.9 mt -66.51 -47.59 72.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.015 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -57.31 -49.15 77.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.676 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.591 ' NZ ' ' HB2' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -59.96 -36.03 76.24 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.608 0.242 . . . . 0.0 110.833 -179.731 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.805 ' HB3' HD13 ' A' ' 180' ' ' ILE . 90.5 mm-40 -57.57 -49.29 76.86 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 120.677 0.275 . . . . 0.0 110.862 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.427 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.3 mm? -58.98 -38.44 79.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.981 0.419 . . . . 0.0 110.968 179.608 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -64.18 -46.44 83.97 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.743 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.462 ' O ' HG23 ' A' ' 141' ' ' VAL . 65.5 mt -65.3 -50.7 71.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.759 -179.414 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.522 ' HB3' HG12 ' A' ' 177' ' ' ILE . 1.9 mp0 -55.0 -46.53 75.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.808 -179.441 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.8 mt -62.3 -41.07 98.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.721 0.296 . . . . 0.0 110.866 179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 60.0 tttm -62.21 -44.62 96.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.692 179.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 137' ' ' ILE . 57.8 t -64.91 -43.69 96.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.974 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.503 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.3 tttt -60.62 -45.68 93.13 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.624 179.804 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -62.69 -45.9 90.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.464 179.616 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.661 ' HA2' HD22 ' A' ' 147' ' ' ASN . . . -60.3 -37.7 93.46 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.886 -0.674 . . . . 0.0 112.124 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.53 ' HB3' HD23 ' A' ' 170' ' ' LEU . . . -64.26 -39.38 93.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.077 0.465 . . . . 0.0 110.014 179.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.7 mt-10 -62.84 -46.29 88.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.283 179.324 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.661 HD22 ' HA2' ' A' ' 144' ' ' GLY . 75.5 m-20 -55.89 -40.52 73.13 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.109 179.346 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.541 ' HG2' ' O ' ' A' ' 144' ' ' GLY . 94.6 mmm -61.87 -47.31 85.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.747 179.577 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . . . . . . . . . 68.9 mt -56.31 -50.84 69.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.929 179.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -59.85 -38.72 82.92 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.5 179.495 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 99.3 m -58.25 -45.93 86.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.123 179.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.408 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 1.8 m-85 -69.79 -36.67 75.9 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.31 -179.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 43.7 t -52.02 -49.55 63.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.752 -179.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 75.3 m-80 -71.35 137.19 48.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.661 179.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -59.24 105.23 0.66 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.467 -0.873 . . . . 0.0 112.298 179.993 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.3 t 178.43 -42.88 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.865 0.364 . . . . 0.0 110.604 -179.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 60.2 p -148.13 47.22 1.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.7 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -78.35 50.15 0.91 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.345 -179.618 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.579 ' HB2' ' HB2' ' A' ' 162' ' ' LEU . 1.5 m-20 -62.05 132.83 54.18 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.795 0.331 . . . . 0.0 110.516 179.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.505 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 22.8 tpp180 -73.1 -54.86 7.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.608 -179.477 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . 0.4 ' HG3' ' N ' ' A' ' 162' ' ' LEU . 60.8 pttt -64.23 -48.55 75.39 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.691 -179.336 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.579 ' HB2' ' HB2' ' A' ' 159' ' ' ASP . 90.2 mt -59.12 -40.75 86.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.37 -179.696 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 51.7 tp -60.57 -42.78 97.33 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.408 179.877 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 160' ' ' ARG . 97.3 mt -55.33 -41.26 72.19 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.022 0.439 . . . . 0.0 109.95 179.362 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.417 ' O ' ' HG2' ' A' ' 169' ' ' MET . 89.4 m -60.38 -45.02 95.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.89 179.327 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -66.76 -45.47 78.42 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.395 -179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -56.13 -44.36 79.07 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.436 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 164' ' ' LEU . 98.2 mm-40 -62.37 -38.04 88.03 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.452 179.13 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 165' ' ' THR . 72.5 mmm -62.39 -46.09 90.18 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.132 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.53 HD23 ' HB3' ' A' ' 145' ' ' ALA . 3.2 tm? -58.97 -46.76 87.31 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.784 -179.776 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.54 -43.13 85.99 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.172 -179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 64.0 t0 -60.98 -45.07 96.29 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.082 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.531 ' O ' HG13 ' A' ' 177' ' ' ILE . 85.1 p -58.46 -45.31 88.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.871 -179.767 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -57.17 -42.67 81.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.754 179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 79.7 m -59.57 -44.36 93.32 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.585 179.623 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.459 ' O ' HG13 ' A' ' 180' ' ' ILE . 28.2 mtpp -61.08 -41.92 97.55 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.48 179.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.531 HG13 ' O ' ' A' ' 173' ' ' SER . 64.4 mt -58.53 -41.02 80.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.836 179.803 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -60.41 -46.09 91.25 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.369 179.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.1 mt -60.11 -46.16 94.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.437 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.805 HD13 ' HB3' ' A' ' 134' ' ' GLN . 69.8 mt -59.17 -40.61 81.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.29 179.28 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -55.24 -42.55 73.57 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.632 . . . . 0.0 110.375 179.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 84.4 mtp -61.75 -40.47 95.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.459 179.408 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 -64.44 -41.65 96.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.726 HD13 HD13 ' A' ' 131' ' ' LEU . 4.5 mm? -64.38 -50.95 65.66 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.817 -179.595 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.523 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 15.7 ptp180 -57.86 -44.74 86.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.654 0.264 . . . . 0.0 111.166 -179.344 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . . . . . . . . . 78.4 mtp180 -64.44 -41.46 96.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.821 0.343 . . . . 0.0 110.953 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -61.94 -45.21 94.69 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.001 179.895 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.576 ' O ' ' HG2' ' A' ' 192' ' ' GLN . 92.5 mt -60.46 -45.57 93.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.824 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 185' ' ' ARG . 98.7 mm-40 -57.39 -38.28 74.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.026 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -62.31 -47.18 85.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.427 -179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.14 -52.24 56.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.322 -179.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 188' ' ' LEU . 25.0 pt20 -70.77 134.57 47.53 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.852 0.358 . . . . 0.0 110.971 -179.791 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.616 HD13 ' N ' ' A' ' 194' ' ' GLU . 2.6 tm? -175.99 129.7 0.24 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.932 179.867 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . 0.616 ' N ' HD13 ' A' ' 193' ' ' LEU . 5.7 tp10 -174.26 134.52 0.42 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.13 -179.948 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . 0.528 HD22 ' N ' ' A' ' 196' ' ' GLN . 0.8 OUTLIER 63.61 126.61 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.177 179.682 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . 0.528 ' N ' HD22 ' A' ' 195' ' ' ASN . 3.1 pt20 -68.28 131.91 46.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.893 179.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -64.28 139.43 58.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.219 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 61.06 62.48 2.75 Favored Pre-proline 0 C--N 1.331 -0.211 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.419 179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 C--O 1.249 1.037 0 C-N-CA 122.598 2.199 . . . . 0.0 112.218 -179.99 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 N-CA-C 112.584 -0.206 . . . . 0.0 112.584 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 10.9 tt -61.17 129.03 90.34 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-O 120.581 0.229 . . . . 0.0 111.116 179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.404 ' HG2' ' H ' ' A' ' 122' ' ' ALA . 45.7 Cg_endo -69.81 -69.86 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.223 1.949 . . . . 0.0 112.422 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.404 ' H ' ' HG2' ' A' ' 121' ' ' PRO . . . 179.36 -54.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.204 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 75.3 p -83.39 33.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.506 -179.775 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -76.34 -42.45 44.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.868 179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 93.6 mt -58.59 -43.2 89.45 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.056 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 81.0 p -64.84 -42.39 94.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.978 -179.973 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 19.7 ttm105 -62.49 -47.71 82.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.299 -179.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.04 -49.82 73.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.978 -179.429 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.01 95.86 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 111.954 0.354 . . . . 0.0 111.954 -179.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' A' ' 134' ' ' GLN . . . -62.09 -51.44 56.86 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.796 -179.619 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 184' ' ' LEU . 88.7 mt -65.77 -38.2 88.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.845 0.355 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 44.5 tp10 -62.06 -49.07 77.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.916 -179.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.498 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -61.72 -40.76 96.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.729 -0.214 . . . . 0.0 111.045 -179.377 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.792 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.5 mm100 -58.56 -44.93 89.87 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.747 0.308 . . . . 0.0 110.836 179.847 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.558 HD22 ' HE ' ' A' ' 181' ' ' ARG . 98.6 mt -62.53 -36.4 82.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.136 0.494 . . . . 0.0 111.041 179.965 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 140' ' ' LYS . . . -67.4 -48.57 66.98 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.433 -179.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 63.2 mt -62.46 -47.33 93.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.936 -179.375 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.538 ' CG ' HG12 ' A' ' 177' ' ' ILE . 12.2 pt-20 -58.28 -39.61 79.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.15 -179.454 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.497 ' C ' HD12 ' A' ' 139' ' ' LEU . 0.2 OUTLIER -70.18 -39.72 75.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.53 -179.925 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.586 ' HG3' ' O ' ' A' ' 136' ' ' ALA . 68.4 mttm -59.34 -48.04 83.14 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.818 0.342 . . . . 0.0 110.735 179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 60.3 t -61.46 -40.89 87.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.523 179.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.1 tttm -59.67 -44.49 93.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.737 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -65.24 -42.38 93.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . -58.56 -40.94 95.22 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.818 -0.706 . . . . 0.0 112.476 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.462 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.64 -40.65 92.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.029 0.442 . . . . 0.0 110.307 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 50.8 mt-10 -62.27 -39.78 94.05 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.472 179.507 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -59.06 -44.13 91.8 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.492 179.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . . . . . . . . . 65.8 mtt -63.88 -45.67 88.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.088 179.692 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 145' ' ' ALA . 68.4 mt -57.88 -47.06 87.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.443 -179.573 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -66.33 -47.58 73.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.765 -179.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 92.6 m -61.26 -47.84 84.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.898 -179.277 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.611 ' HE2' ' HB2' ' A' ' 162' ' ' LEU . 2.5 m-85 -66.35 -26.07 67.1 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.997 -179.292 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 68.4 m -47.14 -40.69 16.19 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 120.799 0.333 . . . . 0.0 110.771 179.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -171.37 118.51 0.46 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.867 179.418 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 146.14 -141.56 9.75 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.675 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.6 t -80.59 143.05 33.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.78 0.324 . . . . 0.0 111.243 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.438 HG22 ' O ' ' A' ' 157' ' ' THR . 17.6 m 61.53 48.41 5.84 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 179.608 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -82.26 39.82 0.61 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.101 179.848 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -67.06 133.04 49.11 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.92 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 43.6 mmm-85 -73.09 -41.13 64.41 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.63 -179.713 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -55.57 -53.35 57.56 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.293 -179.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.611 ' HB2' ' HE2' ' A' ' 152' ' ' TYR . 93.0 mt -64.38 -34.92 79.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.91 179.834 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 56.8 tp -55.28 -48.93 73.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.759 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 94.9 mt -63.41 -42.33 98.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.397 179.681 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 90.8 m -59.02 -42.03 89.18 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.972 179.774 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.4 94.99 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.717 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -57.5 -44.64 85.13 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.273 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 98.0 mm-40 -61.33 -40.38 94.0 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.475 179.241 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 72.9 mtp -58.77 -47.66 83.92 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.441 179.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.897 HD22 ' HE3' ' A' ' 174' ' ' LYS . 2.0 tt -60.87 -40.69 93.92 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.963 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -59.49 -41.46 89.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.421 179.479 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -61.68 -45.51 93.72 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.839 179.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 177' ' ' ILE . 94.1 p -59.1 -40.21 84.64 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.384 179.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.897 ' HE3' HD22 ' A' ' 170' ' ' LEU . 99.6 mttt -57.29 -44.19 83.83 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.669 179.388 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 91.2 m -59.82 -48.13 82.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.36 -179.76 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.565 ' HB3' ' NZ ' ' A' ' 176' ' ' LYS . 3.4 mmmp? -62.28 -47.32 84.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.877 0.37 . . . . 0.0 110.992 -179.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.538 HG12 ' CG ' ' A' ' 138' ' ' GLU . 60.6 mt -57.62 -46.31 86.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.71 -179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -58.84 -47.3 85.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.663 0.268 . . . . 0.0 111.532 -179.56 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 68.0 mt -64.65 -50.58 75.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.9 -179.417 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.792 HD13 ' HB3' ' A' ' 134' ' ' GLN . 66.0 mt -61.3 -44.41 98.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.598 -179.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.558 ' HE ' HD22 ' A' ' 135' ' ' LEU . 19.4 mmt85 -56.22 -40.83 74.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.805 0.336 . . . . 0.0 110.509 179.602 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . . . . . . . . . 50.0 tpp -59.96 -43.4 95.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.272 179.291 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -62.94 -40.29 97.21 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.679 179.517 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 131' ' ' LEU . 4.3 mm? -62.25 -44.24 96.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.685 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.43 ' HG3' ' O ' ' A' ' 181' ' ' ARG . 78.0 mtp180 -57.6 -43.9 85.05 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.619 179.776 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.425 HH11 ' HG3' ' A' ' 186' ' ' ARG . 43.0 mmm-85 -62.33 -42.26 99.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.708 179.613 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -60.07 -41.96 93.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.036 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 86.0 mt -61.73 -45.81 92.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.123 -179.814 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -60.39 -41.87 94.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.082 -179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -63.25 -47.62 81.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.543 -179.766 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -63.67 -59.74 4.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.93 -179.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -95.52 118.4 32.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.87 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.64 49.7 1.86 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.187 0.517 . . . . 0.0 110.225 179.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -71.39 134.21 46.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.845 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -66.21 -48.8 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.805 179.906 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -70.73 140.88 51.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.637 179.812 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -56.75 136.3 55.26 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.276 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . -60.17 136.26 91.13 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.055 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo . . . . . 0 C--O 1.249 1.036 0 C-N-CA 122.547 2.165 . . . . 0.0 112.238 -179.976 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.465 -0.254 . . . . 0.0 112.465 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.694 ' O ' HD12 ' A' ' 120' ' ' ILE . 2.0 pp -60.78 138.13 93.39 Favored Pre-proline 0 C--N 1.33 -0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.734 179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.439 ' HB2' ' H ' ' A' ' 122' ' ' ALA . 73.2 Cg_endo -75.45 -142.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.539 2.159 . . . . 0.0 111.631 179.723 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.439 ' H ' ' HB2' ' A' ' 121' ' ' PRO . . . -82.3 34.0 0.41 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.953 0.406 . . . . 0.0 110.616 179.197 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . 0.649 HG23 ' OD1' ' A' ' 124' ' ' ASN . 3.7 t -78.37 -39.41 39.31 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.64 -179.833 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.649 ' OD1' HG23 ' A' ' 123' ' ' THR . 15.2 p-10 -161.22 36.12 0.14 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.976 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.75 HD12 ' N ' ' A' ' 126' ' ' SER . 4.4 pp -80.1 -35.54 36.7 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.992 0.425 . . . . 0.0 110.44 179.264 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . 0.75 ' N ' HD12 ' A' ' 125' ' ' LEU . 79.5 p -67.59 -39.93 84.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.086 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.409 ' HG2' HH11 ' A' ' 127' ' ' ARG . 15.2 tpp85 -56.27 -59.86 4.33 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.119 -179.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.8 t -56.8 -41.29 75.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.772 179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -57.55 -38.24 74.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.332 179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.847 ' HA2' ' HE3' ' A' ' 133' ' ' LYS . . . -61.86 -57.79 15.88 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.132 179.652 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.857 HD23 HD12 ' A' ' 184' ' ' LEU . 6.8 mp -53.63 -46.12 70.37 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -58.05 -55.0 40.59 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.681 0.277 . . . . 0.0 111.478 -179.493 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.847 ' HE3' ' HA2' ' A' ' 130' ' ' GLY . 22.3 pttp -60.79 -34.16 74.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.895 -179.772 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.797 ' HB3' HD13 ' A' ' 180' ' ' ILE . 3.3 mm100 -60.64 -50.21 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.247 179.809 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.574 HD23 ' O ' ' A' ' 131' ' ' LEU . 4.6 mm? -55.61 -43.5 76.17 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.843 0.354 . . . . 0.0 111.094 179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.99 79.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.416 179.993 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 133' ' ' LYS . 68.5 mt -63.16 -42.53 96.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.581 -179.682 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.716 ' HB3' HD11 ' A' ' 177' ' ' ILE . 69.0 mm-40 -59.09 -44.88 91.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.43 -179.601 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 97.3 mt -60.32 -40.71 91.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.773 0.32 . . . . 0.0 111.001 -179.873 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 25.6 ttpp -62.11 -50.13 73.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.493 -179.795 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.75 -49.96 64.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.993 -179.34 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.467 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 87.9 tttt -57.57 -44.86 85.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.338 -179.433 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -57.87 -51.21 70.55 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.978 -179.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.496 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -60.39 -34.83 86.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.542 179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.518 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -65.23 -40.95 94.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.983 0.42 . . . . 0.0 110.421 179.839 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.1 mt-10 -60.71 -43.72 97.48 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.743 179.706 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.23 -43.37 98.98 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.933 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.496 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 84.1 mtp -63.33 -47.26 82.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.965 179.899 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 145' ' ' ALA . 74.1 mt -56.68 -47.95 81.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.974 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -65.12 -40.03 93.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.039 179.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . . . . . . . . . 91.4 m -56.87 -46.03 82.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.627 -179.77 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.494 ' HB2' HD13 ' A' ' 163' ' ' LEU . 1.9 m-85 -71.76 -39.77 69.77 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.341 -179.726 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . . . . . . . . . 67.0 p -77.12 40.73 0.27 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.913 -179.508 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -178.57 -51.66 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.927 0.394 . . . . 0.0 110.64 179.579 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . -65.74 155.58 50.03 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.324 179.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -49.89 -42.94 48.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.759 0.314 . . . . 0.0 110.826 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 86.0 m -63.49 130.41 44.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.733 179.599 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -150.91 46.01 0.84 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . 0.536 ' HB3' ' HB2' ' A' ' 162' ' ' LEU . 64.1 t0 -59.81 132.36 53.71 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.287 179.876 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.543 ' O ' ' HG ' ' A' ' 164' ' ' LEU . 30.0 tpt180 -66.9 -50.16 63.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.752 -179.135 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.9 -46.22 82.62 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 -178.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 159' ' ' ASP . 77.3 mt -61.17 -45.85 92.9 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 -179.226 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.494 HD13 ' HB2' ' A' ' 152' ' ' TYR . 57.3 tp -60.33 -45.65 92.68 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.0 -0.28 . . . . 0.0 111.119 -179.672 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . 0.558 ' O ' ' HB2' ' A' ' 168' ' ' GLN . 94.8 mt -57.27 -37.26 72.1 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.774 0.321 . . . . 0.0 110.712 179.931 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . 0.48 ' O ' ' HG3' ' A' ' 169' ' ' MET . 88.4 m -61.81 -47.52 84.76 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.163 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . 0.405 ' HB2' ' HE2' ' A' ' 148' ' ' MET . . . -68.15 -49.18 62.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.446 -179.902 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.413 ' O ' ' HG2' ' A' ' 171' ' ' GLN . 25.9 mt-30 -56.96 -36.4 70.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.145 0.498 . . . . 0.0 109.989 179.566 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.558 ' HB2' ' O ' ' A' ' 164' ' ' LEU . 0.5 OUTLIER -62.21 -45.91 91.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.997 179.63 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . 0.48 ' HG3' ' O ' ' A' ' 165' ' ' THR . 58.8 mtm -60.48 -39.33 87.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.658 179.674 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.557 ' O ' HD13 ' A' ' 170' ' ' LEU . 2.9 tm? -60.77 -42.04 96.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.437 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 167' ' ' GLN . 12.0 mm100 -64.96 -47.52 77.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.524 -179.749 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 60.0 m-20 -64.08 -42.27 97.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.816 -179.356 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.526 ' O ' HG13 ' A' ' 177' ' ' ILE . 86.2 p -57.83 -47.53 82.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.33 -179.075 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -60.92 -48.01 83.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.607 -179.627 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 89.7 m -58.04 -48.6 79.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.707 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.486 ' HE3' ' OE1' ' A' ' 138' ' ' GLU . 54.6 mtmt -59.28 -43.64 92.52 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.047 -179.801 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.716 HD11 ' HB3' ' A' ' 138' ' ' GLU . 72.2 mt -60.9 -35.57 65.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.183 179.919 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . 0.551 ' O ' ' HG2' ' A' ' 182' ' ' MET . 65.2 m-20 -62.25 -49.82 74.18 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.686 0.279 . . . . 0.0 110.806 179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 39.9 mm -62.42 -50.17 80.95 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.038 0.447 . . . . 0.0 110.872 -179.971 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.797 HD13 ' HB3' ' A' ' 134' ' ' GLN . 88.4 mt -55.37 -49.92 69.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.277 179.555 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.718 ' HA ' HD13 ' A' ' 184' ' ' LEU . 79.5 ttt180 -49.47 -40.27 36.61 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.348 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.551 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 26.4 mmt -57.8 -41.06 81.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.867 178.951 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.548 ' CB ' HD21 ' A' ' 131' ' ' LEU . 25.9 mt-30 -66.62 -36.91 83.73 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.057 179.482 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.857 HD12 HD23 ' A' ' 131' ' ' LEU . 6.8 mp -61.29 -56.95 14.68 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 120.728 0.299 . . . . 0.0 111.28 -179.739 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.497 ' O ' ' HG3' ' A' ' 189' ' ' GLN . 15.0 ptp180 -60.47 -43.23 97.15 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.747 -179.189 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.404 HH11 ' HG2' ' A' ' 186' ' ' ARG . 15.0 tpp85 -60.12 -44.97 94.5 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.803 0.335 . . . . 0.0 110.987 -179.77 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -64.18 -43.98 93.44 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.479 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . 0.59 ' HG ' ' O ' ' A' ' 184' ' ' LEU . 84.3 mt -64.13 -46.59 83.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.664 -179.421 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 185' ' ' ARG . 87.5 mt-30 -56.81 -41.56 77.98 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.64 0.257 . . . . 0.0 111.436 -179.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -70.12 -56.51 6.69 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -179.384 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -75.86 -60.91 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.693 -179.043 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 188' ' ' LEU . 41.0 tt0 -68.44 140.66 55.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.187 -179.726 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . . . . . . . . . 60.5 tp -172.13 130.84 0.62 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.309 179.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -57.63 -54.44 46.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.054 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 44.4 t30 -178.99 132.04 0.12 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.942 179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 -67.49 134.48 51.41 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.717 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -63.01 132.07 50.76 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.179 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . 0.549 ' N ' ' HD3' ' A' ' 199' ' ' PRO . . . -174.52 54.68 0.15 Allowed Pre-proline 0 CA--C 1.531 0.222 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.273 179.92 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . 0.549 ' HD3' ' N ' ' A' ' 198' ' ' ALA . 35.2 Cg_exo . . . . . 0 C--O 1.248 1.0 0 C-N-CA 122.413 2.075 . . . . 0.0 112.266 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.205 0 N-CA-C 112.396 -0.281 . . . . 0.0 112.396 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . 0.464 ' HA ' ' HD3' ' A' ' 121' ' ' PRO . 67.5 mt 64.55 132.91 0.03 OUTLIER Pre-proline 0 CA--C 1.531 0.25 0 CA-C-O 120.696 0.284 . . . . 0.0 111.168 -179.915 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 120' ' ' ILE . 26.6 Cg_exo -62.84 -135.9 0.0 OUTLIER 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.723 2.282 . . . . 0.0 112.478 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -162.67 47.17 0.15 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.843 0.354 . . . . 0.0 111.043 -179.938 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 70.2 p -134.85 40.74 2.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -174.5 35.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.545 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.571 ' O ' HD13 ' A' ' 125' ' ' LEU . 2.9 tm? -68.56 -40.9 80.44 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.332 179.924 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 83.6 p -53.13 -43.5 66.99 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.15 -179.926 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 131' ' ' LEU . 20.7 ttm105 -63.18 -43.79 97.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.761 179.989 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.471 ' O ' ' HG2' ' A' ' 132' ' ' GLU . 60.7 t -58.55 -45.94 90.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.995 179.954 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -61.27 -42.95 99.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 179.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.718 ' HA2' ' HE2' ' A' ' 133' ' ' LYS . . . -62.09 -40.61 99.17 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.333 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 127' ' ' ARG . 89.0 mt -67.34 -42.75 83.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.898 0.38 . . . . 0.0 110.914 179.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 128' ' ' VAL . 67.7 mm-40 -63.79 -46.8 83.58 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.75 -179.727 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.718 ' HE2' ' HA2' ' A' ' 130' ' ' GLY . 65.9 pttt -59.98 -41.19 91.47 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.661 0.267 . . . . 0.0 111.229 -179.316 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' GLN . . . . . 0.583 ' HG2' ' O ' ' A' ' 130' ' ' GLY . 98.0 mm-40 -59.32 -46.24 89.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.793 0.33 . . . . 0.0 110.883 179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 135' ' ' LEU . . . . . 0.52 ' O ' ' HG ' ' A' ' 139' ' ' LEU . 60.0 tp -61.42 -41.93 97.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.102 -179.844 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -58.25 -46.88 85.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.285 -179.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 67.5 mt -59.15 -42.41 86.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.708 179.925 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.662 ' HB3' HD11 ' A' ' 177' ' ' ILE . 65.0 mm-40 -61.97 -40.05 94.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.129 179.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 135' ' ' LEU . 93.6 mt -59.8 -42.4 93.36 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.209 -179.676 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -64.83 -49.19 71.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.189 -179.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 141' ' ' VAL . . . . . . . . . . . . . 47.6 t -63.68 -46.93 93.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.166 -179.854 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 142' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' GLU . 62.8 tttm -61.88 -44.16 97.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.629 179.961 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 4.6 tm0? -58.69 -44.84 90.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.06 179.675 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 144' ' ' GLY . . . . . 0.465 ' O ' ' HG3' ' A' ' 148' ' ' MET . . . -65.16 -35.08 91.27 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 179.571 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 145' ' ' ALA . . . . . 0.536 ' O ' HG13 ' A' ' 149' ' ' ILE . . . -66.58 -41.09 89.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.924 0.392 . . . . 0.0 110.542 179.953 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' LYS . 56.0 mt-10 -61.72 -42.54 99.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.687 179.722 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -61.99 -39.44 92.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.523 179.591 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 148' ' ' MET . . . . . 0.465 ' HG3' ' O ' ' A' ' 144' ' ' GLY . 85.8 mtp -67.81 -41.49 83.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.274 179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 149' ' ' ILE . . . . . 0.536 HG13 ' O ' ' A' ' 145' ' ' ALA . 73.5 mt -63.33 -47.5 91.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.439 -179.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 150' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 146' ' ' GLU . 3.1 pt20 -68.83 -45.36 71.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.768 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 151' ' ' THR . . . . . 0.413 ' C ' ' H ' ' A' ' 153' ' ' SER . 93.2 m -66.04 -48.35 71.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.873 -179.377 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 152' ' ' TYR . . . . . 0.492 ' O ' HD13 ' A' ' 163' ' ' LEU . 1.4 m-85 -74.47 23.1 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.832 -179.518 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 153' ' ' SER . . . . . 0.413 ' H ' ' C ' ' A' ' 151' ' ' THR . 37.4 t -166.06 66.98 0.11 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.645 0.259 . . . . 0.0 111.189 -179.724 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 154' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -160.01 -54.67 0.06 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.622 179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 167.26 56.57 0.03 OUTLIER Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.886 -179.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 47.0 t -160.39 -44.59 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.806 0.336 . . . . 0.0 111.082 -179.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 15.3 t -68.83 -150.02 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.829 -179.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -176.65 -47.28 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.77 0.319 . . . . 0.0 110.777 179.714 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -75.54 120.38 20.88 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.013 179.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 48.9 mmt-85 -74.15 -30.71 62.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.998 179.44 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -53.24 -46.78 69.31 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.02 -179.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 162' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.75 -40.33 96.46 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.059 179.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 163' ' ' LEU . . . . . 0.492 HD13 ' O ' ' A' ' 152' ' ' TYR . 62.3 tp -57.43 -48.02 80.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.832 0.348 . . . . 0.0 110.578 179.739 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 88.9 mt -63.9 -39.63 94.62 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.166 179.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 165' ' ' THR . . . . . . . . . . . . . 84.8 m -56.47 -44.61 80.77 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.658 179.618 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 166' ' ' ALA . . . . . . . . . . . . . . . -62.44 -41.3 98.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.828 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 167' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 163' ' ' LEU . 81.2 mt-30 -58.03 -42.53 85.53 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.153 179.61 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.36 -40.03 85.14 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.768 179.119 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 169' ' ' MET . . . . . . . . . . . . . 70.1 mtp -59.92 -47.31 86.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.634 179.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 170' ' ' LEU . . . . . 0.489 HD13 ' C ' ' A' ' 170' ' ' LEU . 3.1 tm? -57.4 -47.49 81.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.675 -179.754 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 171' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -60.59 -42.04 95.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.06 -179.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -57.46 -46.41 83.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.002 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 173' ' ' SER . . . . . 0.512 ' O ' HG13 ' A' ' 177' ' ' ILE . 51.1 m -62.09 -42.97 99.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.919 -179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 174' ' ' LYS . . . . . 0.577 ' HB3' ' NZ ' ' A' ' 174' ' ' LYS . 3.7 mmmp? -57.54 -42.99 84.03 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.492 -179.723 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 175' ' ' THR . . . . . . . . . . . . . 90.7 m -61.37 -48.73 79.91 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.406 -179.634 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 180' ' ' ILE . 68.3 mttm -62.87 -46.59 87.16 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.196 -179.801 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.662 HD11 ' HB3' ' A' ' 138' ' ' GLU . 54.6 mt -59.99 -40.23 82.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.138 -179.776 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 178' ' ' ASP . . . . . 0.503 ' O ' ' HG2' ' A' ' 182' ' ' MET . 8.2 t70 -58.03 -44.67 87.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.001 0.429 . . . . 0.0 109.99 179.526 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 179' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.99 -43.05 97.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.926 179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 180' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 176' ' ' LYS . 71.3 mt -59.88 -46.78 93.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.129 -179.876 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 181' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' A' ' 177' ' ' ILE . 73.1 mtt-85 -55.48 -44.2 76.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.67 179.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 182' ' ' MET . . . . . 0.503 ' HG2' ' O ' ' A' ' 178' ' ' ASP . 92.2 mmm -59.69 -37.5 78.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.491 179.577 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -67.34 -38.93 85.62 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.089 179.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 184' ' ' LEU . . . . . 0.48 HD22 HD13 ' A' ' 131' ' ' LEU . 9.2 mt -60.49 -53.95 51.35 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.179 0.514 . . . . 0.0 110.768 -179.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 185' ' ' ARG . . . . . 0.534 ' O ' ' HG2' ' A' ' 189' ' ' GLN . 7.7 ptm180 -64.2 -43.02 96.34 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.179 -179.879 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 186' ' ' ARG . . . . . 0.598 ' HA ' ' NE2' ' A' ' 189' ' ' GLN . 46.1 ttm-85 -62.3 -36.11 81.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.129 -179.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 187' ' ' ALA . . . . . . . . . . . . . . . -65.78 -43.62 88.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.682 -179.59 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 188' ' ' LEU . . . . . . . . . . . . . 81.9 mt -65.73 -49.32 68.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.878 -179.2 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 189' ' ' GLN . . . . . 0.598 ' NE2' ' HA ' ' A' ' 186' ' ' ARG . 16.4 pt20 -59.5 -47.49 85.3 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.858 0.361 . . . . 0.0 111.644 -179.601 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 190' ' ' ALA . . . . . . . . . . . . . . . -67.0 -39.21 87.07 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.612 -179.244 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 191' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -60.62 -32.64 71.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.114 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 192' ' ' GLN . . . . . 0.443 ' HG2' ' N ' ' A' ' 193' ' ' LEU . 8.2 tt0 -157.05 -116.48 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.471 -179.526 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 193' ' ' LEU . . . . . 0.443 ' N ' ' HG2' ' A' ' 192' ' ' GLN . 60.8 tp 68.08 -65.22 0.26 Allowed 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 122.651 0.38 . . . . 0.0 111.994 179.77 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 194' ' ' GLU . . . . . . . . . . . . . 89.3 tt0 65.96 129.14 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 120.85 0.357 . . . . 0.0 111.128 -179.7 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 195' ' ' ASN . . . . . . . . . . . . . 46.3 t30 63.67 125.73 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.133 -179.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 196' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -74.07 139.95 45.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.248 179.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 197' ' ' ALA . . . . . . . . . . . . . . . -61.81 142.51 57.27 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.486 -179.678 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 198' ' ' ALA . . . . . . . . . . . . . . . 65.78 138.5 0.05 OUTLIER Pre-proline 0 N--CA 1.462 0.17 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.494 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 199' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo . . . . . 0 C--O 1.25 1.087 0 C-N-CA 122.471 2.114 . . . . 0.0 112.287 -179.933 . . . . . . . . 0 0 . 1 stop_ save_